methyl 4-(1,1-diphenyloct-1-en-2-yl)benzenesulfonate

Systemtic Name: methyl 4-(1,1-diphenyloct-1-en-2-yl)benzenesulfonate Openeye Name: methyl 4-(1-benzhydrylideneheptyl)benzenesulfonate CAS Name: 4-(1,1-diphenyloct-1-en-2-yl)benzenesulfonic acid methyl ester IUPAC Name: methyl 4-(1,1-diphenyloct-1-en-2-yl)benzenesulfonate Traditional Name: 4-(1-hexyl-2,2-diphenyl-vinyl)benzenesulfonic acid methyl ester Formula: C27H30O3S MolecularWeight: 434.5903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=C(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)OC

Isomeric SMILES

CCCCCCC(=C(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)OC

InChI

InChI=1S/C27H30O3S/c1-3-4-5-12-17-26(22-18-20-25(21-19-22)31(28,29)30-2)27(23-13-8-6-9-14-23)24-15-10-7-11-16-24/h6-11,13-16,18-21H,3-5,12,17H2,1-2H3