3-(1,3-benzodioxol-5-yl)-5-(4-methoxy-3-methyl-phenyl)-5-oxidanyl-4-(phenylmethyl)furan-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-(4-methoxy-3-methyl-phenyl)-5-oxidanyl-4-(phenylmethyl)furan-2-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-4-benzyl-5-hydroxy-5-(4-methoxy-3-methyl-phenyl)furan-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-5-hydroxy-5-(4-methoxy-3-methylphenyl)-4-(phenylmethyl)-2-furanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-4-benzyl-5-hydroxy-5-(4-methoxy-3-methylphenyl)furan-2-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-4-benzyl-5-hydroxy-5-(4-methoxy-3-methyl-phenyl)furan-2-one Formula: C26H22O6 MolecularWeight: 430.44928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(C(=C(C(=O)O2)C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5)O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2(C(=C(C(=O)O2)C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5)O)OC

InChI

InChI=1S/C26H22O6/c1-16-12-19(9-11-21(16)29-2)26(28)20(13-17-6-4-3-5-7-17)24(25(27)32-26)18-8-10-22-23(14-18)31-15-30-22/h3-12,14,28H,13,15H2,1-2H3