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

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-5-(4-methylphenyl)-5-oxidanyl-furan-2-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-5-hydroxy-5-(p-tolyl)furan-2-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-5-hydroxy-5-(4-methylphenyl)-2-furanone IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-5-hydroxy-5-(4-methylphenyl)furan-2-one Traditional Name: 5-hydroxy-3-piperonyl-5-(p-tolyl)furan-2-one Formula: C19H16O5 MolecularWeight: 324.32734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(C=C(C(=O)O2)CC3=CC4=C(C=C3)OCO4)O

Isomeric SMILES

CC1=CC=C(C=C1)C2(C=C(C(=O)O2)CC3=CC4=C(C=C3)OCO4)O

InChI

InChI=1S/C19H16O5/c1-12-2-5-15(6-3-12)19(21)10-14(18(20)24-19)8-13-4-7-16-17(9-13)23-11-22-16/h2-7,9-10,21H,8,11H2,1H3