Chem
J-GLOBAL ID:200907019532190498
Nikkaji number:J2.007.697F
(3S)-N-Allyl-N-(4-methoxybenzyl)-1-phenyl-1-heptyne-3-amine
(3S)-N-アリル-N-(4-メトキシベンジル)-1-フェニル-1-ヘプチン-3-アミン
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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:
C24 H29 NO
Molecular formula furigana:
C24-H29-N-O
Molecular weight:
347.502
InChI:
InChI=1S/C24H29NO/c1-4-6-12-23(16-13-21-10-8-7-9-11-21)25(19-5-2)20-22-14-17-24(26-3)18-15-22/h5,7-11,14-15,17-18,23H,2,4,6,12,19-20H2,1,3H3/t23-/m0/s1
InChI key:
SERFDDFJXJQIPP-QHCPKHFHSA-N
SMILES:
CCCC[C@@H](C#Cc1ccccc1)N(CC=C)Cc1ccc(OC)cc1
Systematic name (3):
(3S)-N-アリル-N-(4-メトキシベンジル)-1-フェニル-1-ヘプチン-3-アミン
[(4-メトキシフェニル)メチル][(3S)-1-フェニルヘプタ-1-イン-3-イル](プロパ-2-エン-1-イル)アミン
[(4-methoxyphenyl)methyl][(3S)-1-phenylhept-1-yn-3-yl](prop-2-en-1-yl)amine
Other name (1):
(3S)-N-Allyl-N-(4-methoxybenzyl)-1-phenyl-1-heptyne-3-amine
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