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

Systemtic Name: methyl 4-(1,1-diphenylheptadec-1-en-2-yl)benzenesulfonate Openeye Name: methyl 4-(1-benzhydrylidenehexadecyl)benzenesulfonate CAS Name: 4-(1,1-diphenylheptadec-1-en-2-yl)benzenesulfonic acid methyl ester IUPAC Name: methyl 4-(1,1-diphenylheptadec-1-en-2-yl)benzenesulfonate Traditional Name: 4-(1-pentadecyl-2,2-diphenyl-vinyl)benzenesulfonic acid methyl ester Formula: C36H48O3S MolecularWeight: 560.82952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H48O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-21-26-35(31-27-29-34(30-28-31)40(37,38)39-2)36(32-22-17-15-18-23-32)33-24-19-16-20-25-33/h15-20,22-25,27-30H,3-14,21,26H2,1-2H3