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

Systemtic Name: methyl 2-(3-ethyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)ethanoate Openeye Name: methyl 2-(3-ethyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetate CAS Name: 2-(3-ethyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetic acid methyl ester IUPAC Name: methyl 2-(3-ethyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetate Traditional Name: 2-(3-ethyl-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetic acid methyl ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)CC(=O)OC

Isomeric SMILES

CCC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)CC(=O)OC

InChI

InChI=1S/C20H20N2O3/c1-3-16-20(24)22(13-18(23)25-2)17-12-8-7-11-15(17)19(21-16)14-9-5-4-6-10-14/h4-12,16H,3,13H2,1-2H3