[(E)-2-[5,5-dimethyl-8-(phenylsulfonyl)-6H-naphthalen-1-yl]ethenyl] benzoate

Systemtic Name: [(E)-2-[5,5-dimethyl-8-(phenylsulfonyl)-6H-naphthalen-1-yl]ethenyl] benzoate Openeye Name: [(E)-2-[8-(benzenesulfonyl)-5,5-dimethyl-6H-naphthalen-1-yl]vinyl] benzoate CAS Name: benzoic acid [(E)-2-[8-(benzenesulfonyl)-5,5-dimethyl-6H-naphthalen-1-yl]ethenyl] ester IUPAC Name: [(E)-2-[8-(benzenesulfonyl)-5,5-dimethyl-6H-naphthalen-1-yl]ethenyl] benzoate Traditional Name: benzoic acid [(E)-2-(8-besyl-5,5-dimethyl-6H-naphthalen-1-yl)vinyl] ester Formula: C27H24O4S MolecularWeight: 444.54206

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C2=C(C=CC=C21)C=COC(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC=C(C2=C(C=CC=C21)/C=C/OC(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H24O4S/c1-27(2)18-16-24(32(29,30)22-13-7-4-8-14-22)25-20(12-9-15-23(25)27)17-19-31-26(28)21-10-5-3-6-11-21/h3-17,19H,18H2,1-2H3/b19-17+