6-(4-bromophenyl)-10,11-dimethoxy-7,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one

Systemtic Name: 6-(4-bromophenyl)-10,11-dimethoxy-7,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one Openeye Name: 6-(4-bromophenyl)-10,11-dimethoxy-7,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one CAS Name: 6-(4-bromophenyl)-10,11-dimethoxy-7,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one IUPAC Name: 6-(4-bromophenyl)-10,11-dimethoxy-7,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one Traditional Name: 6-(4-bromophenyl)-10,11-dimethoxy-7,7a-dihydroisoindolo[2,3-a][1,5]benzodiazepin-12-one Formula: C24H19BrN2O3 MolecularWeight: 463.32326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C3CC(=NC4=CC=CC=C4N3C2=O)C5=CC=C(C=C5)Br)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C3CC(=NC4=CC=CC=C4N3C2=O)C5=CC=C(C=C5)Br)OC

InChI

InChI=1S/C24H19BrN2O3/c1-29-21-12-11-16-20-13-18(14-7-9-15(25)10-8-14)26-17-5-3-4-6-19(17)27(20)24(28)22(16)23(21)30-2/h3-12,20H,13H2,1-2H3