3-(1,3-benzodioxol-5-yl)-5-(3-methylphenyl)-5-oxidanyl-4-(phenylmethyl)furan-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-(3-methylphenyl)-5-oxidanyl-4-(phenylmethyl)furan-2-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-4-benzyl-5-hydroxy-5-(m-tolyl)furan-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-5-hydroxy-5-(3-methylphenyl)-4-(phenylmethyl)-2-furanone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-4-benzyl-5-hydroxy-5-(3-methylphenyl)furan-2-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-4-benzyl-5-hydroxy-5-(m-tolyl)furan-2-one Formula: C25H20O5 MolecularWeight: 400.4233

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20O5/c1-16-6-5-9-19(12-16)25(27)20(13-17-7-3-2-4-8-17)23(24(26)30-25)18-10-11-21-22(14-18)29-15-28-21/h2-12,14,27H,13,15H2,1H3