2-oxidanyl-3-[(2-oxidanyl-3-oxidanylidene-5-propan-2-yl-cyclohepta-1,4,6-trien-1-yl)-(4-phenylmethoxyphenyl)methyl]-6-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-oxidanyl-3-[(2-oxidanyl-3-oxidanylidene-5-propan-2-yl-cyclohepta-1,4,6-trien-1-yl)-(4-phenylmethoxyphenyl)methyl]-6-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 3-[(4-benzyloxyphenyl)-(2-hydroxy-5-isopropyl-3-oxo-cyclohepta-1,4,6-trien-1-yl)methyl]-2-hydroxy-6-isopropyl-cyclohepta-2,4,6-trien-1-one CAS Name: 2-hydroxy-3-[(2-hydroxy-3-oxo-5-propan-2-yl-1-cyclohepta-1,4,6-trienyl)-(4-phenylmethoxyphenyl)methyl]-6-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-hydroxy-3-[(2-hydroxy-3-oxo-5-propan-2-ylcyclohepta-1,4,6-trien-1-yl)-(4-phenylmethoxyphenyl)methyl]-6-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 3-[(4-benzoxyphenyl)-(2-hydroxy-5-isopropyl-3-keto-cyclohepta-1,4,6-trien-1-yl)methyl]-2-hydroxy-6-isopropyl-cyclohepta-2,4,6-trien-1-one Formula: C34H34O5 MolecularWeight: 522.63076

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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)OCC3=CC=CC=C3)C4=C(C(=O)C=C(C=C4)C(C)C)O)O

Isomeric SMILES

CC(C)C1=CC(=O)C(=C(C=C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=C(C(=O)C=C(C=C4)C(C)C)O)O

InChI

InChI=1S/C34H34O5/c1-21(2)25-12-16-28(33(37)30(35)18-25)32(29-17-13-26(22(3)4)19-31(36)34(29)38)24-10-14-27(15-11-24)39-20-23-8-6-5-7-9-23/h5-19,21-22,32H,20H2,1-4H3,(H,35,37)(H,36,38)