4-methyl-2-[3-oxidanylidene-1-(2-phenyl-1H-indol-3-yl)-1H-isoindol-2-yl]-N-propyl-pentanamide

Systemtic Name: 4-methyl-2-[3-oxidanylidene-1-(2-phenyl-1H-indol-3-yl)-1H-isoindol-2-yl]-N-propyl-pentanamide Openeye Name: 4-methyl-2-[1-oxo-3-(2-phenyl-1H-indol-3-yl)isoindolin-2-yl]-N-propyl-pentanamide CAS Name: 4-methyl-2-[3-oxo-1-(2-phenyl-1H-indol-3-yl)-1H-isoindol-2-yl]-N-propylpentanamide IUPAC Name: 4-methyl-2-[3-oxo-1-(2-phenyl-1H-indol-3-yl)-1H-isoindol-2-yl]-N-propylpentanamide Traditional Name: 2-[1-keto-3-(2-phenyl-1H-indol-3-yl)isoindolin-2-yl]-4-methyl-N-propyl-valeramide Formula: C31H33N3O2 MolecularWeight: 479.61262

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(CC(C)C)N1C(C2=CC=CC=C2C1=O)C3=C(NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CCCNC(=O)C(CC(C)C)N1C(C2=CC=CC=C2C1=O)C3=C(NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C31H33N3O2/c1-4-18-32-30(35)26(19-20(2)3)34-29(22-14-8-9-15-23(22)31(34)36)27-24-16-10-11-17-25(24)33-28(27)21-12-6-5-7-13-21/h5-17,20,26,29,33H,4,18-19H2,1-3H3,(H,32,35)