methyl (2E)-2-(1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)ethanoate

Systemtic Name: methyl (2E)-2-(1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)ethanoate Openeye Name: methyl (2E)-2-(1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)acetate CAS Name: (2E)-2-(1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)acetic acid methyl ester IUPAC Name: methyl (2E)-2-(1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)acetate Traditional Name: (2E)-2-(1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)acetic acid methyl ester Formula: C19H18N2O2 MolecularWeight: 306.35842

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)OC)CN=C(C2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

CN1/C(=C/C(=O)OC)/CN=C(C2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O2/c1-21-15(12-18(22)23-2)13-20-19(14-8-4-3-5-9-14)16-10-6-7-11-17(16)21/h3-12H,13H2,1-2H3/b15-12+