5-[(E)-2-(3-bromanyl-4-methoxy-phenyl)ethenyl]-1-methyl-2,3-dihydro-1,4-benzodiazepine

Systemtic Name: 5-[(E)-2-(3-bromanyl-4-methoxy-phenyl)ethenyl]-1-methyl-2,3-dihydro-1,4-benzodiazepine Openeye Name: 5-[(E)-2-(3-bromo-4-methoxy-phenyl)vinyl]-1-methyl-2,3-dihydro-1,4-benzodiazepine CAS Name: 5-[(E)-2-(3-bromo-4-methoxyphenyl)ethenyl]-1-methyl-2,3-dihydro-1,4-benzodiazepine IUPAC Name: 5-[(E)-2-(3-bromo-4-methoxyphenyl)ethenyl]-1-methyl-2,3-dihydro-1,4-benzodiazepine Traditional Name: 5-[(E)-2-(3-bromo-4-methoxy-phenyl)vinyl]-1-methyl-2,3-dihydro-1,4-benzodiazepine Formula: C19H19BrN2O MolecularWeight: 371.27096

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C(C2=CC=CC=C21)C=CC3=CC(=C(C=C3)OC)Br

Isomeric SMILES

CN1CCN=C(C2=CC=CC=C21)/C=C/C3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C19H19BrN2O/c1-22-12-11-21-17(15-5-3-4-6-18(15)22)9-7-14-8-10-19(23-2)16(20)13-14/h3-10,13H,11-12H2,1-2H3/b9-7+