(3S)-2-(3-methylbutyl)-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one

Systemtic Name: (3S)-2-(3-methylbutyl)-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one Openeye Name: (3S)-2-isopentyl-3-(2-phenyl-1H-indol-3-yl)isoindolin-1-one CAS Name: (3S)-2-(3-methylbutyl)-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one IUPAC Name: (3S)-2-(3-methylbutyl)-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one Traditional Name: (3S)-2-isoamyl-3-(2-phenyl-1H-indol-3-yl)isoindolin-1-one Formula: C27H26N2O MolecularWeight: 394.50814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(C2=CC=CC=C2C1=O)C3=C(NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC(C)CCN1[C@@H](C2=CC=CC=C2C1=O)C3=C(NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H26N2O/c1-18(2)16-17-29-26(20-12-6-7-13-21(20)27(29)30)24-22-14-8-9-15-23(22)28-25(24)19-10-4-3-5-11-19/h3-15,18,26,28H,16-17H2,1-2H3/t26-/m0/s1