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

Systemtic Name: [7-chloranyl-2-(methylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] ethanoate Openeye Name: [7-chloro-2-(methylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] acetate CAS Name: acetic acid [7-chloro-2-(methylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] ester IUPAC Name: [7-chloro-2-(methylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] acetate Traditional Name: acetic acid [7-chloro-2-(methylamino)-5-phenyl-3H-1,4-benzodiazepin-3-yl] ester Formula: C18H16ClN3O2 MolecularWeight: 341.79154

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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)NC

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN3O2/c1-11(23)24-18-17(20-2)21-15-9-8-13(19)10-14(15)16(22-18)12-6-4-3-5-7-12/h3-10,18H,1-2H3,(H,20,21)