3-(2-methoxy-4-methyl-5-phenylazanyl-phenyl)-3-(2-oxidanyl-4-pyrrolidin-1-yl-phenyl)-2-benzofuran-1-one

Systemtic Name: 3-(2-methoxy-4-methyl-5-phenylazanyl-phenyl)-3-(2-oxidanyl-4-pyrrolidin-1-yl-phenyl)-2-benzofuran-1-one Openeye Name: 3-(5-anilino-2-methoxy-4-methyl-phenyl)-3-(2-hydroxy-4-pyrrolidin-1-yl-phenyl)isobenzofuran-1-one CAS Name: 3-(5-anilino-2-methoxy-4-methylphenyl)-3-[2-hydroxy-4-(1-pyrrolidinyl)phenyl]-1-isobenzofuranone IUPAC Name: 3-(5-anilino-2-methoxy-4-methylphenyl)-3-(2-hydroxy-4-pyrrolidin-1-ylphenyl)-2-benzofuran-1-one Traditional Name: 3-(5-anilino-2-methoxy-4-methyl-phenyl)-3-(2-hydroxy-4-pyrrolidino-phenyl)phthalide Formula: C32H30N2O4 MolecularWeight: 506.5916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)OC)C2(C3=CC=CC=C3C(=O)O2)C4=C(C=C(C=C4)N5CCCC5)O)NC6=CC=CC=C6

Isomeric SMILES

CC1=C(C=C(C(=C1)OC)C2(C3=CC=CC=C3C(=O)O2)C4=C(C=C(C=C4)N5CCCC5)O)NC6=CC=CC=C6

InChI

InChI=1S/C32H30N2O4/c1-21-18-30(37-2)27(20-28(21)33-22-10-4-3-5-11-22)32(25-13-7-6-12-24(25)31(36)38-32)26-15-14-23(19-29(26)35)34-16-8-9-17-34/h3-7,10-15,18-20,33,35H,8-9,16-17H2,1-2H3