Chem
J-GLOBAL ID：201807005464751876   Nikkaji number：J3.723.994A

2-[Bis(carboxymethyl)amino]-6-[[(4-isothiocyanatophenyl)acetyl]amino]hexanoic acid

2-[ビス(カルボキシメチル)アミノ]-6-[2-(4-イソチオシアナトフェニル)アセトアミド]ヘキサン酸
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： C19H23N3O7S
Molecular formula furigana： C19-H23-N3-O7-S
Molecular weight： 437.470
InChI： InChI=1S/C19H23N3O7S/c23-16(9-13-4-6-14(7-5-13)21-12-30)20-8-2-1-3-15(19(28)29)22(10-17(24)25)11-18(26)27/h4-7,15H,1-3,8-11H2,(H,20,23)(H,24,25)(H,26,27)(H,28,29)
InChI key： AXPNNEAEZMILEI-UHFFFAOYSA-N
SMILES： OC(=O)CN(CC(=O)O)C(CCCCNC(=O)Cc1ccc(cc1)N=C=S)C(=O)O
Systematic name  (3)：
  • 2-[ビス(カルボキシメチル)アミノ]-6-[[(4-イソチオシアナトフェニル)アセチル]アミノ]ヘキサン酸
  • 2-[ビス(カルボキシメチル)アミノ]-6-[2-(4-イソチオシアナトフェニル)アセトアミド]ヘキサン酸
  • 2-[bis(carboxymethyl)amino]-6-[2-(4-isothiocyanatophenyl)acetamido]hexanoic acid
Other name (1)：
  • 2-[Bis(carboxymethyl)amino]-6-[[(4-isothiocyanatophenyl)acetyl]amino]hexanoic acid
Thsaurus map：
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