(3S)-3-(5-methoxy-2-oxidanyl-phenyl)carbonyl-2-(4-methylphenyl)-3H-isoindol-1-one

Systemtic Name: (3S)-3-(5-methoxy-2-oxidanyl-phenyl)carbonyl-2-(4-methylphenyl)-3H-isoindol-1-one Openeye Name: (3S)-3-(2-hydroxy-5-methoxy-benzoyl)-2-(p-tolyl)isoindolin-1-one CAS Name: (3S)-3-[(2-hydroxy-5-methoxyphenyl)-oxomethyl]-2-(4-methylphenyl)-3H-isoindol-1-one IUPAC Name: (3S)-3-(2-hydroxy-5-methoxybenzoyl)-2-(4-methylphenyl)-3H-isoindol-1-one Traditional Name: (3S)-3-(2-hydroxy-5-methoxy-benzoyl)-2-(p-tolyl)isoindolin-1-one Formula: C23H19NO4 MolecularWeight: 373.40126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C3=CC=CC=C3C2=O)C(=O)C4=C(C=CC(=C4)OC)O

Isomeric SMILES

CC1=CC=C(C=C1)N2[C@@H](C3=CC=CC=C3C2=O)C(=O)C4=C(C=CC(=C4)OC)O

InChI

InChI=1S/C23H19NO4/c1-14-7-9-15(10-8-14)24-21(17-5-3-4-6-18(17)23(24)27)22(26)19-13-16(28-2)11-12-20(19)25/h3-13,21,25H,1-2H3/t21-/m0/s1