3-[[2-(4-methoxyphenyl)-2-oxidanyl-ethyl]amino]-3-phenyl-2-(phenylmethyl)isoindol-1-one

Systemtic Name: 3-[[2-(4-methoxyphenyl)-2-oxidanyl-ethyl]amino]-3-phenyl-2-(phenylmethyl)isoindol-1-one Openeye Name: 2-benzyl-3-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]-3-phenyl-isoindolin-1-one CAS Name: 3-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]-3-phenyl-2-(phenylmethyl)-1-isoindolone IUPAC Name: 2-benzyl-3-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]-3-phenylisoindol-1-one Traditional Name: 2-benzyl-3-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]-3-phenyl-isoindolin-1-one Formula: C30H28N2O3 MolecularWeight: 464.55492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC2(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC2(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C30H28N2O3/c1-35-25-18-16-23(17-19-25)28(33)20-31-30(24-12-6-3-7-13-24)27-15-9-8-14-26(27)29(34)32(30)21-22-10-4-2-5-11-22/h2-19,28,31,33H,20-21H2,1H3