3-[(4-chlorophenyl)methyl]-1-ethyl-7,8-dimethoxy-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-[(4-chlorophenyl)methyl]-1-ethyl-7,8-dimethoxy-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-[(4-chlorophenyl)methyl]-1-ethyl-7,8-dimethoxy-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-[(4-chlorophenyl)methyl]-1-ethyl-7,8-dimethoxy-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-[(4-chlorophenyl)methyl]-1-ethyl-7,8-dimethoxy-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-(4-chlorobenzyl)-1-ethyl-7,8-dimethoxy-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C26H25ClN2O3 MolecularWeight: 448.9413

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC(=C(C=C2C(=NC(C1=O)CC3=CC=C(C=C3)Cl)C4=CC=CC=C4)OC)OC

Isomeric SMILES

CCN1C2=CC(=C(C=C2C(=NC(C1=O)CC3=CC=C(C=C3)Cl)C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C26H25ClN2O3/c1-4-29-22-16-24(32-3)23(31-2)15-20(22)25(18-8-6-5-7-9-18)28-21(26(29)30)14-17-10-12-19(27)13-11-17/h5-13,15-16,21H,4,14H2,1-3H3