[2-methyl-4-[1-[3-methyl-4-(3-methylphenyl)carbonyloxy-phenyl]-3-oxidanylidene-2-benzofuran-1-yl]phenyl] 3-methylbenzoate

Systemtic Name: [2-methyl-4-[1-[3-methyl-4-(3-methylphenyl)carbonyloxy-phenyl]-3-oxidanylidene-2-benzofuran-1-yl]phenyl] 3-methylbenzoate Openeye Name: [2-methyl-4-[1-[3-methyl-4-(3-methylbenzoyl)oxy-phenyl]-3-oxo-isobenzofuran-1-yl]phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [2-methyl-4-[1-[3-methyl-4-[(3-methylphenyl)-oxomethoxy]phenyl]-3-oxo-1-isobenzofuranyl]phenyl] ester IUPAC Name: [2-methyl-4-[1-[3-methyl-4-(3-methylbenzoyl)oxyphenyl]-3-oxo-2-benzofuran-1-yl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-[3-keto-1-(3-methyl-4-m-toluoyloxy-phenyl)phthalan-1-yl]-2-methyl-phenyl] ester Formula: C38H30O6 MolecularWeight: 582.6412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5)OC(=O)C6=CC(=CC=C6)C)C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)C3(C4=CC=CC=C4C(=O)O3)C5=CC(=C(C=C5)OC(=O)C6=CC(=CC=C6)C)C)C

InChI

InChI=1S/C38H30O6/c1-23-9-7-11-27(19-23)35(39)42-33-17-15-29(21-25(33)3)38(32-14-6-5-13-31(32)37(41)44-38)30-16-18-34(26(4)22-30)43-36(40)28-12-8-10-24(2)20-28/h5-22H,1-4H3