4-[4-[1-oxidanyl-3-oxidanylidene-2-(phenylmethyl)isoindol-1-yl]phenyl]-N-propyl-butanamide

Systemtic Name: 4-[4-[1-oxidanyl-3-oxidanylidene-2-(phenylmethyl)isoindol-1-yl]phenyl]-N-propyl-butanamide Openeye Name: 4-[4-(2-benzyl-1-hydroxy-3-oxo-isoindolin-1-yl)phenyl]-N-propyl-butanamide CAS Name: 4-[4-[1-hydroxy-3-oxo-2-(phenylmethyl)-1-isoindolyl]phenyl]-N-propylbutanamide IUPAC Name: 4-[4-(2-benzyl-1-hydroxy-3-oxoisoindol-1-yl)phenyl]-N-propylbutanamide Traditional Name: 4-[4-(2-benzyl-1-hydroxy-3-keto-isoindolin-1-yl)phenyl]-N-propyl-butyramide Formula: C28H30N2O3 MolecularWeight: 442.5494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CCCC1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)O

Isomeric SMILES

CCCNC(=O)CCCC1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)O

InChI

InChI=1S/C28H30N2O3/c1-2-19-29-26(31)14-8-11-21-15-17-23(18-16-21)28(33)25-13-7-6-12-24(25)27(32)30(28)20-22-9-4-3-5-10-22/h3-7,9-10,12-13,15-18,33H,2,8,11,14,19-20H2,1H3,(H,29,31)