2-methyl-3-oxidanylidene-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid

Systemtic Name: 2-methyl-3-oxidanylidene-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid Openeye Name: 2-methyl-3-oxo-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid CAS Name: 2-methyl-3-oxo-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid IUPAC Name: 2-methyl-3-oxo-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid Traditional Name: 3-keto-2-methyl-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepine-8-carboxylic acid Formula: C19H20N2O3 MolecularWeight: 324.3737

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(N1)C=C(C=C2)C(=O)O)CCC3=CC=CC=C3

Isomeric SMILES

CC1C(=O)N(CC2=C(N1)C=C(C=C2)C(=O)O)CCC3=CC=CC=C3

InChI

InChI=1S/C19H20N2O3/c1-13-18(22)21(10-9-14-5-3-2-4-6-14)12-16-8-7-15(19(23)24)11-17(16)20-13/h2-8,11,13,20H,9-10,12H2,1H3,(H,23,24)