4-[(3,4-dimethoxyphenyl)methyl]-6H-pyrrolo[1,2-a][1,4]benzodiazepine

Systemtic Name: 4-[(3,4-dimethoxyphenyl)methyl]-6H-pyrrolo[1,2-a][1,4]benzodiazepine Openeye Name: 4-[(3,4-dimethoxyphenyl)methyl]-6H-pyrrolo[1,2-a][1,4]benzodiazepine CAS Name: 4-[(3,4-dimethoxyphenyl)methyl]-6H-pyrrolo[1,2-a][1,4]benzodiazepine IUPAC Name: 4-[(3,4-dimethoxyphenyl)methyl]-6H-pyrrolo[1,2-a][1,4]benzodiazepine Traditional Name: 4-veratryl-6H-pyrrolo[1,2-a][1,4]benzodiazepine Formula: C21H20N2O2 MolecularWeight: 332.3957

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2=NCC3=CC=CC=C3N4C2=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2=NCC3=CC=CC=C3N4C2=CC=C4)OC

InChI

InChI=1S/C21H20N2O2/c1-24-20-10-9-15(13-21(20)25-2)12-17-19-8-5-11-23(19)18-7-4-3-6-16(18)14-22-17/h3-11,13H,12,14H2,1-2H3