1-(4-bromanyl-3-methoxy-phenyl)-4-[1-(3,4-dimethoxyphenyl)ethyl]-5H-1,4-diazepine

Systemtic Name: 1-(4-bromanyl-3-methoxy-phenyl)-4-[1-(3,4-dimethoxyphenyl)ethyl]-5H-1,4-diazepine Openeye Name: 1-(4-bromo-3-methoxy-phenyl)-4-[1-(3,4-dimethoxyphenyl)ethyl]-5H-1,4-diazepine CAS Name: 1-(4-bromo-3-methoxyphenyl)-4-[1-(3,4-dimethoxyphenyl)ethyl]-5H-1,4-diazepine IUPAC Name: 1-(4-bromo-3-methoxyphenyl)-4-[1-(3,4-dimethoxyphenyl)ethyl]-5H-1,4-diazepine Traditional Name: 1-(4-bromo-3-methoxy-phenyl)-4-[1-(3,4-dimethoxyphenyl)ethyl]-5H-1,4-diazepine Formula: C22H25BrN2O3 MolecularWeight: 445.3495

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)OC)N2CC=CN(C=C2)C3=CC(=C(C=C3)Br)OC

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)OC)N2CC=CN(C=C2)C3=CC(=C(C=C3)Br)OC

InChI

InChI=1S/C22H25BrN2O3/c1-16(17-6-9-20(26-2)22(14-17)28-4)24-10-5-11-25(13-12-24)18-7-8-19(23)21(15-18)27-3/h5-9,11-16H,10H2,1-4H3