(3S)-3-[2-(4-bromophenyl)-1-methyl-indol-3-yl]-2-cyclohexyl-3H-isoindol-1-one

Systemtic Name: (3S)-3-[2-(4-bromophenyl)-1-methyl-indol-3-yl]-2-cyclohexyl-3H-isoindol-1-one Openeye Name: (3S)-3-[2-(4-bromophenyl)-1-methyl-indol-3-yl]-2-cyclohexyl-isoindolin-1-one CAS Name: (3S)-3-[2-(4-bromophenyl)-1-methyl-3-indolyl]-2-cyclohexyl-3H-isoindol-1-one IUPAC Name: (3S)-3-[2-(4-bromophenyl)-1-methylindol-3-yl]-2-cyclohexyl-3H-isoindol-1-one Traditional Name: (3S)-3-[2-(4-bromophenyl)-1-methyl-indol-3-yl]-2-cyclohexyl-isoindolin-1-one Formula: C29H27BrN2O MolecularWeight: 499.44148

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C3=CC=C(C=C3)Br)C4C5=CC=CC=C5C(=O)N4C6CCCCC6

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C3=CC=C(C=C3)Br)[C@@H]4C5=CC=CC=C5C(=O)N4C6CCCCC6

InChI

InChI=1S/C29H27BrN2O/c1-31-25-14-8-7-13-24(25)26(27(31)19-15-17-20(30)18-16-19)28-22-11-5-6-12-23(22)29(33)32(28)21-9-3-2-4-10-21/h5-8,11-18,21,28H,2-4,9-10H2,1H3/t28-/m0/s1