[7-chloranyl-2-(dimethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] ethanoate

Systemtic Name: [7-chloranyl-2-(dimethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] ethanoate Openeye Name: [7-chloro-2-(dimethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] acetate CAS Name: acetic acid [7-chloro-2-(dimethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] ester IUPAC Name: [7-chloro-2-(dimethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] acetate Traditional Name: acetic acid [7-chloro-2-(dimethylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] ester Formula: C19H18ClN3O2 MolecularWeight: 355.81812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(=NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)N(C)C

Isomeric SMILES

CC(=O)OC1C(=NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)N(C)C

InChI

InChI=1S/C19H18ClN3O2/c1-12(24)25-19-18(23(2)3)21-16-10-9-14(20)11-15(16)17(22-19)13-7-5-4-6-8-13/h4-11,19H,1-3H3