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

Systemtic Name: (3S)-3-[2-(4-bromophenyl)-1-methyl-indol-3-yl]-2-tert-butyl-3H-isoindol-1-one Openeye Name: (3S)-3-[2-(4-bromophenyl)-1-methyl-indol-3-yl]-2-tert-butyl-isoindolin-1-one CAS Name: (3S)-3-[2-(4-bromophenyl)-1-methyl-3-indolyl]-2-tert-butyl-3H-isoindol-1-one IUPAC Name: (3S)-3-[2-(4-bromophenyl)-1-methylindol-3-yl]-2-tert-butyl-3H-isoindol-1-one Traditional Name: (3S)-3-[2-(4-bromophenyl)-1-methyl-indol-3-yl]-2-tert-butyl-isoindolin-1-one Formula: C27H25BrN2O MolecularWeight: 473.4042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(C2=CC=CC=C2C1=O)C3=C(N(C4=CC=CC=C43)C)C5=CC=C(C=C5)Br

Isomeric SMILES

CC(C)(C)N1[C@@H](C2=CC=CC=C2C1=O)C3=C(N(C4=CC=CC=C43)C)C5=CC=C(C=C5)Br

InChI

InChI=1S/C27H25BrN2O/c1-27(2,3)30-25(19-9-5-6-10-20(19)26(30)31)23-21-11-7-8-12-22(21)29(4)24(23)17-13-15-18(28)16-14-17/h5-16,25H,1-4H3/t25-/m0/s1