2-[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-3-(1,2-dimethylindol-3-yl)-3H-isoindol-1-one

Systemtic Name: 2-[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]-3-(1,2-dimethylindol-3-yl)-3H-isoindol-1-one Openeye Name: 2-[2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]-3-(1,2-dimethylindol-3-yl)isoindolin-1-one CAS Name: 2-[1-(1-azepanyl)-1-oxopropan-2-yl]-3-(1,2-dimethyl-3-indolyl)-3H-isoindol-1-one IUPAC Name: 2-[1-(azepan-1-yl)-1-oxopropan-2-yl]-3-(1,2-dimethylindol-3-yl)-3H-isoindol-1-one Traditional Name: 2-[2-(azepan-1-yl)-2-keto-1-methyl-ethyl]-3-(1,2-dimethylindol-3-yl)isoindolin-1-one Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)C3C4=CC=CC=C4C(=O)N3C(C)C(=O)N5CCCCCC5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)C3C4=CC=CC=C4C(=O)N3C(C)C(=O)N5CCCCCC5

InChI

InChI=1S/C27H31N3O2/c1-18-24(22-14-8-9-15-23(22)28(18)3)25-20-12-6-7-13-21(20)27(32)30(25)19(2)26(31)29-16-10-4-5-11-17-29/h6-9,12-15,19,25H,4-5,10-11,16-17H2,1-3H3