methyl 2-(7-azanyl-3-oxidanylidene-2,5-dihydro-1H-2,4-benzodiazepin-4-yl)ethanoate

Systemtic Name: methyl 2-(7-azanyl-3-oxidanylidene-2,5-dihydro-1H-2,4-benzodiazepin-4-yl)ethanoate Openeye Name: methyl 2-(7-amino-3-oxo-2,5-dihydro-1H-2,4-benzodiazepin-4-yl)acetate CAS Name: 2-(7-amino-3-oxo-2,5-dihydro-1H-2,4-benzodiazepin-4-yl)acetic acid methyl ester IUPAC Name: methyl 2-(7-amino-3-oxo-2,5-dihydro-1H-2,4-benzodiazepin-4-yl)acetate Traditional Name: 2-(7-amino-3-keto-2,5-dihydro-1H-2,4-benzodiazepin-4-yl)acetic acid methyl ester Formula: C12H15N3O3 MolecularWeight: 249.2658

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CC2=C(CNC1=O)C=CC(=C2)N

Isomeric SMILES

COC(=O)CN1CC2=C(CNC1=O)C=CC(=C2)N

InChI

InChI=1S/C12H15N3O3/c1-18-11(16)7-15-6-9-4-10(13)3-2-8(9)5-14-12(15)17/h2-4H,5-7,13H2,1H3,(H,14,17)