3,6,6-trimethyl-2-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonyl-5,7-dihydro-1H-indol-4-one

Systemtic Name: 3,6,6-trimethyl-2-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonyl-5,7-dihydro-1H-indol-4-one Openeye Name: 3,6,6-trimethyl-2-[(2S)-2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]-5,7-dihydro-1H-indol-4-one CAS Name: 3,6,6-trimethyl-2-[[(2S)-2-(1-methyl-2-pyrrolyl)-1-azepanyl]-oxomethyl]-5,7-dihydro-1H-indol-4-one IUPAC Name: 3,6,6-trimethyl-2-[(2S)-2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]-5,7-dihydro-1H-indol-4-one Traditional Name: 3,6,6-trimethyl-2-[(2S)-2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]-5,7-dihydro-1H-indol-4-one Formula: C23H31N3O2 MolecularWeight: 381.51114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C(=O)CC(C2)(C)C)C(=O)N3CCCCCC3C4=CC=CN4C

Isomeric SMILES

CC1=C(NC2=C1C(=O)CC(C2)(C)C)C(=O)N3CCCCC[C@H]3C4=CC=CN4C

InChI

InChI=1S/C23H31N3O2/c1-15-20-16(13-23(2,3)14-19(20)27)24-21(15)22(28)26-12-7-5-6-9-18(26)17-10-8-11-25(17)4/h8,10-11,18,24H,5-7,9,12-14H2,1-4H3/t18-/m0/s1