methyl 2-(3-azanyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethanoate

Systemtic Name: methyl 2-(3-azanyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethanoate Openeye Name: methyl 2-(3-amino-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetate CAS Name: 2-(3-amino-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetic acid methyl ester IUPAC Name: methyl 2-(3-amino-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetate Traditional Name: 2-(3-amino-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetic acid methyl ester Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)N)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CN1C2=CC=CC=C2C(=NC(C1=O)N)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3/c1-24-15(22)11-21-14-10-6-5-9-13(14)16(20-17(19)18(21)23)12-7-3-2-4-8-12/h2-10,17H,11,19H2,1H3