2-[(5-methyl-4-oxidanylidene-2-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)-(5-methyl-4-oxidanyl-2-propan-2-yl-phenyl)methyl]benzenesulfonic acid

Systemtic Name: 2-[(5-methyl-4-oxidanylidene-2-propan-2-yl-cyclohexa-2,5-dien-1-ylidene)-(5-methyl-4-oxidanyl-2-propan-2-yl-phenyl)methyl]benzenesulfonic acid Openeye Name: 2-[(4-hydroxy-2-isopropyl-5-methyl-phenyl)-(2-isopropyl-5-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonic acid CAS Name: 2-[(4-hydroxy-5-methyl-2-propan-2-ylphenyl)-(5-methyl-4-oxo-2-propan-2-yl-1-cyclohexa-2,5-dienylidene)methyl]benzenesulfonic acid IUPAC Name: 2-[(4-hydroxy-5-methyl-2-propan-2-ylphenyl)-(5-methyl-4-oxo-2-propan-2-ylcyclohexa-2,5-dien-1-ylidene)methyl]benzenesulfonic acid Traditional Name: 2-[(4-hydroxy-2-isopropyl-5-methyl-phenyl)-(2-isopropyl-4-keto-5-methyl-cyclohexa-2,5-dien-1-ylidene)methyl]besylic acid Formula: C27H30O5S MolecularWeight: 466.5891

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=CC=CC=C2S(=O)(=O)O)C3=CC(=C(C=C3C(C)C)O)C)C(=CC1=O)C(C)C

Isomeric SMILES

CC1=CC(=C(C2=CC=CC=C2S(=O)(=O)O)C3=CC(=C(C=C3C(C)C)O)C)C(=CC1=O)C(C)C

InChI

InChI=1S/C27H30O5S/c1-15(2)20-13-24(28)17(5)11-22(20)27(19-9-7-8-10-26(19)33(30,31)32)23-12-18(6)25(29)14-21(23)16(3)4/h7-16,28H,1-6H3,(H,30,31,32)