3-[6-(2-bromophenyl)benzo[b][1,4]benzodiazepin-11-yl]propan-1-amine

Systemtic Name: 3-[6-(2-bromophenyl)benzo[b][1,4]benzodiazepin-11-yl]propan-1-amine Openeye Name: 3-[6-(2-bromophenyl)benzo[b][1,4]benzodiazepin-11-yl]propan-1-amine CAS Name: 3-[6-(2-bromophenyl)-11-benzo[b][1,4]benzodiazepinyl]-1-propanamine IUPAC Name: 3-[6-(2-bromophenyl)benzo[b][1,4]benzodiazepin-11-yl]propan-1-amine Traditional Name: 3-[6-(2-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=C4Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC3=CC=CC=C3N2CCCN)C4=CC=CC=C4Br

InChI

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