2-[(1R)-1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]-N-[(2S)-octan-2-yl]ethanamide

Systemtic Name: 2-[(1R)-1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]-N-[(2S)-octan-2-yl]ethanamide Openeye Name: 2-[(1R)-1-(1H-indol-3-yl)-3-oxo-isoindolin-2-yl]-N-[(1S)-1-methylheptyl]acetamide CAS Name: 2-[(1R)-1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]-N-[(2S)-octan-2-yl]acetamide IUPAC Name: 2-[(1R)-1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]-N-[(2S)-octan-2-yl]acetamide Traditional Name: 2-[(1R)-1-(1H-indol-3-yl)-3-keto-isoindolin-2-yl]-N-[(1S)-1-methylheptyl]acetamide Formula: C26H31N3O2 MolecularWeight: 417.54324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)CN1C(C2=CC=CC=C2C1=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CCCCCC[C@H](C)NC(=O)CN1[C@H](C2=CC=CC=C2C1=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C26H31N3O2/c1-3-4-5-6-11-18(2)28-24(30)17-29-25(20-13-7-8-14-21(20)26(29)31)22-16-27-23-15-10-9-12-19(22)23/h7-10,12-16,18,25,27H,3-6,11,17H2,1-2H3,(H,28,30)/t18-,25+/m0/s1