3-[(4-methoxyphenyl)-(2-oxidanyl-3-oxidanylidene-5-propan-2-yl-cyclohepta-1,4,6-trien-1-yl)methyl]-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-[(4-methoxyphenyl)-(2-oxidanyl-3-oxidanylidene-5-propan-2-yl-cyclohepta-1,4,6-trien-1-yl)methyl]-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 4-hydroxy-3-[(2-hydroxy-5-isopropyl-3-oxo-cyclohepta-1,4,6-trien-1-yl)-(4-methoxyphenyl)methyl]naphthalene-1,2-dione CAS Name: 4-hydroxy-3-[(2-hydroxy-3-oxo-5-propan-2-yl-1-cyclohepta-1,4,6-trienyl)-(4-methoxyphenyl)methyl]naphthalene-1,2-dione IUPAC Name: 4-hydroxy-3-[(2-hydroxy-3-oxo-5-propan-2-ylcyclohepta-1,4,6-trien-1-yl)-(4-methoxyphenyl)methyl]naphthalene-1,2-dione Traditional Name: 4-hydroxy-3-[(2-hydroxy-5-isopropyl-3-keto-cyclohepta-1,4,6-trien-1-yl)-(4-methoxyphenyl)methyl]-1,2-naphthoquinone Formula: C28H24O6 MolecularWeight: 456.48656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)C(=C(C=C1)C(C2=CC=C(C=C2)OC)C3=C(C4=CC=CC=C4C(=O)C3=O)O)O

Isomeric SMILES

CC(C)C1=CC(=O)C(=C(C=C1)C(C2=CC=C(C=C2)OC)C3=C(C4=CC=CC=C4C(=O)C3=O)O)O

InChI

InChI=1S/C28H24O6/c1-15(2)17-10-13-21(25(30)22(29)14-17)23(16-8-11-18(34-3)12-9-16)24-26(31)19-6-4-5-7-20(19)27(32)28(24)33/h4-15,23,31H,1-3H3,(H,29,30)