4-[2-(3-methoxyphenyl)-2-oxidanyl-ethyl]-7a-methyl-2,3,6,7-tetrahydroindene-1,5-dione

Systemtic Name: 4-[2-(3-methoxyphenyl)-2-oxidanyl-ethyl]-7a-methyl-2,3,6,7-tetrahydroindene-1,5-dione Openeye Name: 4-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-7a-methyl-2,3,6,7-tetrahydroindene-1,5-dione CAS Name: 4-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-7a-methyl-2,3,6,7-tetrahydroindene-1,5-dione IUPAC Name: 4-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-7a-methyl-2,3,6,7-tetrahydroindene-1,5-dione Traditional Name: 4-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-7a-methyl-2,3,6,7-tetrahydroindene-1,5-quinone Formula: C19H22O4 MolecularWeight: 314.37558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(=O)C(=C1CCC2=O)CC(C3=CC(=CC=C3)OC)O

Isomeric SMILES

CC12CCC(=O)C(=C1CCC2=O)CC(C3=CC(=CC=C3)OC)O

InChI

InChI=1S/C19H22O4/c1-19-9-8-16(20)14(15(19)6-7-18(19)22)11-17(21)12-4-3-5-13(10-12)23-2/h3-5,10,17,21H,6-9,11H2,1-2H3