Chem
J-GLOBAL ID:200907052502711350
Nikkaji number:J1.659.069J
(2S)-3(2H)-Oxo-4-methyl-4,5-dihydro-1H-1,4-benzodiazepine-2β-acetic acid
(2S)-3(2H)-オキソ-4-メチル-4,5-ジヒドロ-1H-1,4-ベンゾジアゼピン-2β-酢酸
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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:
C12 H14 N2 O3
Molecular formula furigana:
C12-H14-N2-O3
Molecular weight:
234.255
InChI:
InChI=1S/C12H14N2O3/c1-14-7-8-4-2-3-5-9(8)13-10(12(14)17)6-11(15)16/h2-5,10,13H,6-7H2,1H3,(H,15,16)/t10-/m0/s1
InChI key:
CLWDLBDPVUWYEW-JTQLQIEISA-N
SMILES:
CN1Cc2ccccc2N[C@@H](CC(=O)O)C1=O
Systematic name (3):
(2S)-3(2H)-オキソ-4-メチル-4,5-ジヒドロ-1H-1,4-ベンゾジアゼピン-2β-酢酸
2-[(2S)-4-メチル-3-オキソ-2,3,4,5-テトラヒドロ-1H-1,4-ベンゾジアゼピン-2-イル]酢酸
2-[(2S)-4-methyl-3-oxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-yl]acetic acid
Other name (1):
(2S)-3(2H)-Oxo-4-methyl-4,5-dihydro-1H-1,4-benzodiazepine-2β-acetic acid
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