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

Systemtic Name: 3-[[(4-methoxyphenyl)-oxidanyl-methyl]amino]-3-phenyl-2-(phenylmethyl)isoindol-1-one Openeye Name: 2-benzyl-3-[[hydroxy-(4-methoxyphenyl)methyl]amino]-3-phenyl-isoindolin-1-one CAS Name: 3-[[hydroxy-(4-methoxyphenyl)methyl]amino]-3-phenyl-2-(phenylmethyl)-1-isoindolone IUPAC Name: 2-benzyl-3-[[hydroxy-(4-methoxyphenyl)methyl]amino]-3-phenylisoindol-1-one Traditional Name: 2-benzyl-3-[[hydroxy-(4-methoxyphenyl)methyl]amino]-3-phenyl-isoindolin-1-one Formula: C29H26N2O3 MolecularWeight: 450.52834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(NC2(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

COC1=CC=C(C=C1)C(NC2(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C29H26N2O3/c1-34-24-18-16-22(17-19-24)27(32)30-29(23-12-6-3-7-13-23)26-15-9-8-14-25(26)28(33)31(29)20-21-10-4-2-5-11-21/h2-19,27,30,32H,20H2,1H3