phenyl 4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-4-methyl-cyclohexa-1,5-diene-1-sulfonate

Systemtic Name: phenyl 4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-4-methyl-cyclohexa-1,5-diene-1-sulfonate Openeye Name: phenyl 4-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-4-methyl-cyclohexa-1,5-diene-1-sulfonate CAS Name: 4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-4-methyl-1-cyclohexa-1,5-dienesulfonic acid phenyl ester IUPAC Name: phenyl 4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]-4-methylcyclohexa-1,5-diene-1-sulfonate Traditional Name: 4-[(E)-2-(3,5-dimethoxyphenyl)vinyl]-4-methyl-cyclohexa-1,5-diene-1-sulfonic acid phenyl ester Formula: C23H24O5S MolecularWeight: 412.49866

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2)C=CC3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC1(CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2)/C=C/C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C23H24O5S/c1-23(12-9-18-15-20(26-2)17-21(16-18)27-3)13-10-22(11-14-23)29(24,25)28-19-7-5-4-6-8-19/h4-13,15-17H,14H2,1-3H3/b12-9+