[(E)-5-phenylpent-4-enyl] 4-methylbenzenesulfonate

Systemtic Name: [(E)-5-phenylpent-4-enyl] 4-methylbenzenesulfonate Openeye Name: [(E)-5-phenylpent-4-enyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(E)-5-phenylpent-4-enyl] ester IUPAC Name: [(E)-5-phenylpent-4-enyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(E)-5-phenylpent-4-enyl] ester Formula: C18H20O3S MolecularWeight: 316.4146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC=CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC/C=C/C2=CC=CC=C2

InChI

InChI=1S/C18H20O3S/c1-16-11-13-18(14-12-16)22(19,20)21-15-7-3-6-10-17-8-4-2-5-9-17/h2,4-6,8-14H,3,7,15H2,1H3/b10-6+