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

Systemtic Name: 2-[(4-methoxyphenyl)-(2-oxidanyl-3-oxidanylidene-5-propan-2-yl-cyclohepta-1,4,6-trien-1-yl)methyl]-3-methyl-naphthalene-1,4-dione Openeye Name: 2-[(2-hydroxy-5-isopropyl-3-oxo-cyclohepta-1,4,6-trien-1-yl)-(4-methoxyphenyl)methyl]-3-methyl-naphthalene-1,4-dione CAS Name: 2-[(2-hydroxy-3-oxo-5-propan-2-yl-1-cyclohepta-1,4,6-trienyl)-(4-methoxyphenyl)methyl]-3-methylnaphthalene-1,4-dione IUPAC Name: 2-[(2-hydroxy-3-oxo-5-propan-2-ylcyclohepta-1,4,6-trien-1-yl)-(4-methoxyphenyl)methyl]-3-methylnaphthalene-1,4-dione Traditional Name: 2-[(2-hydroxy-5-isopropyl-3-keto-cyclohepta-1,4,6-trien-1-yl)-(4-methoxyphenyl)methyl]-3-methyl-1,4-naphthoquinone Formula: C29H26O5 MolecularWeight: 454.51374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2C1=O)C(C3=CC=C(C=C3)OC)C4=C(C(=O)C=C(C=C4)C(C)C)O

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2C1=O)C(C3=CC=C(C=C3)OC)C4=C(C(=O)C=C(C=C4)C(C)C)O

InChI

InChI=1S/C29H26O5/c1-16(2)19-11-14-23(28(32)24(30)15-19)26(18-9-12-20(34-4)13-10-18)25-17(3)27(31)21-7-5-6-8-22(21)29(25)33/h5-16,26H,1-4H3,(H,30,32)