3-(4-chloranyl-5-methyl-2-oxidanyl-phenyl)-3-[4-(dimethylamino)-2-methoxy-phenyl]-2-benzofuran-1-one

Systemtic Name: 3-(4-chloranyl-5-methyl-2-oxidanyl-phenyl)-3-[4-(dimethylamino)-2-methoxy-phenyl]-2-benzofuran-1-one Openeye Name: 3-(4-chloro-2-hydroxy-5-methyl-phenyl)-3-[4-(dimethylamino)-2-methoxy-phenyl]isobenzofuran-1-one CAS Name: 3-(4-chloro-2-hydroxy-5-methylphenyl)-3-[4-(dimethylamino)-2-methoxyphenyl]-1-isobenzofuranone IUPAC Name: 3-(4-chloro-2-hydroxy-5-methylphenyl)-3-[4-(dimethylamino)-2-methoxyphenyl]-2-benzofuran-1-one Traditional Name: 3-(4-chloro-2-hydroxy-5-methyl-phenyl)-3-[4-(dimethylamino)-2-methoxy-phenyl]phthalide Formula: C24H22ClNO4 MolecularWeight: 423.88878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)C2(C3=CC=CC=C3C(=O)O2)C4=C(C=C(C=C4)N(C)C)OC)O)Cl

Isomeric SMILES

CC1=C(C=C(C(=C1)C2(C3=CC=CC=C3C(=O)O2)C4=C(C=C(C=C4)N(C)C)OC)O)Cl

InChI

InChI=1S/C24H22ClNO4/c1-14-11-19(21(27)13-20(14)25)24(17-8-6-5-7-16(17)23(28)30-24)18-10-9-15(26(2)3)12-22(18)29-4/h5-13,27H,1-4H3