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

Systemtic Name: N-[(2S)-heptan-2-yl]-2-[(1S)-1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]ethanamide Openeye Name: 2-[(1S)-1-(1H-indol-3-yl)-3-oxo-isoindolin-2-yl]-N-[(1S)-1-methylhexyl]acetamide CAS Name: N-[(2S)-heptan-2-yl]-2-[(1S)-1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]acetamide IUPAC Name: N-[(2S)-heptan-2-yl]-2-[(1S)-1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]acetamide Traditional Name: 2-[(1S)-1-(1H-indol-3-yl)-3-keto-isoindolin-2-yl]-N-[(1S)-1-methylhexyl]acetamide Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29N3O2/c1-3-4-5-10-17(2)27-23(29)16-28-24(19-12-6-7-13-20(19)25(28)30)21-15-26-22-14-9-8-11-18(21)22/h6-9,11-15,17,24,26H,3-5,10,16H2,1-2H3,(H,27,29)/t17-,24-/m0/s1