Chem
J-GLOBAL ID:200907090933571563   Nikkaji number:J1.888.116K

(2S,3R)-2-(Benzhydrylideneamino)-3-(4-methoxyphenyl)-3-(tosylamino)propanoic acid methyl ester

(2S,3R)-2-(ベンズヒドリリデンアミノ)-3-(4-メトキシフェニル)-3-(トシルアミノ)プロパン酸メチル
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C31H30N2O5S
Molecular formula furigana: C31-H30-N2-O5-S
Molecular weight: 542.650
InChI: InChI=1S/C31H30N2O5S/c1-22-14-20-27(21-15-22)39(35,36)33-29(25-16-18-26(37-2)19-17-25)30(31(34)38-3)32-28(23-10-6-4-7-11-23)24-12-8-5-9-13-24/h4-21,29-30,33H,1-3H3/t29-,30+/m1/s1
InChI key: KBJMLBGTIMTMIA-IHLOFXLRSA-N
SMILES: COC(=O)[C@@H](N=C(c1ccccc1)c1ccccc1)[C@H](NS(=O)(=O)c1ccc(C)cc1)c1ccc(OC)cc1
Systematic name  (4):
  • (2S,3R)-2-(ベンズヒドリリデンアミノ)-3-(トシルアミノ)-3-(4-メトキシフェニル)プロピオン酸メチル
  • (2S,3R)-2-(ベンズヒドリリデンアミノ)-3-(4-メトキシフェニル)-3-(トシルアミノ)プロパン酸メチル
  • メチル (2S,3R)-2-[(ジフェニルメチリデン)アミノ]-3-(4-メトキシフェニル)-3-(4-メチルベンゼンスルホンアミド)プロパノアート
  • methyl (2S,3R)-2-[(diphenylmethylidene)amino]-3-(4-methoxyphenyl)-3-(4-methylbenzenesulfonamido)propanoate
Other name (2):
  • (2S,3R)-2-(Benzhydrylideneamino)-3-(tosylamino)-3-(4-methoxyphenyl)propionic acid methyl ester
  • (2S,3R)-2-(Benzhydrylideneamino)-3-(4-methoxyphenyl)-3-(tosylamino)propanoic acid methyl ester
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