3-[6-(3-bromophenyl)benzo[b][1,4]benzodiazepin-11-yl]propan-1-amine

Systemtic Name: 3-[6-(3-bromophenyl)benzo[b][1,4]benzodiazepin-11-yl]propan-1-amine Openeye Name: 3-[6-(3-bromophenyl)benzo[b][1,4]benzodiazepin-11-yl]propan-1-amine CAS Name: 3-[6-(3-bromophenyl)-11-benzo[b][1,4]benzodiazepinyl]-1-propanamine IUPAC Name: 3-[6-(3-bromophenyl)benzo[b][1,4]benzodiazepin-11-yl]propan-1-amine Traditional Name: 3-[6-(3-bromophenyl)benzo[b][1,4]benzodiazepin-11-yl]propylamine Formula: C22H20BrN3 MolecularWeight: 406.3183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC3=CC=CC=C3N2CCCN)C4=CC(=CC=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC3=CC=CC=C3N2CCCN)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H20BrN3/c23-17-8-5-7-16(15-17)22-18-9-1-3-11-20(18)26(14-6-13-24)21-12-4-2-10-19(21)25-22/h1-5,7-12,15H,6,13-14,24H2