[2-(4-tert-butylphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [2-(4-tert-butylphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] 4-methylbenzenesulfonate Openeye Name: [2-(4-tert-butylphenyl)-7-methyl-4-oxo-chromen-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(4-tert-butylphenyl)-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-tert-butylphenyl)-7-methyl-4-oxochromen-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(4-tert-butylphenyl)-4-keto-7-methyl-chromen-3-yl] ester Formula: C27H26O5S MolecularWeight: 462.55734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(OC3=C(C2=O)C=CC(=C3)C)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(OC3=C(C2=O)C=CC(=C3)C)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H26O5S/c1-17-6-13-21(14-7-17)33(29,30)32-26-24(28)22-15-8-18(2)16-23(22)31-25(26)19-9-11-20(12-10-19)27(3,4)5/h6-16H,1-5H3