1-phenylpent-4-enyl 4-methylbenzenesulfonate

Systemtic Name: 1-phenylpent-4-enyl 4-methylbenzenesulfonate Openeye Name: 1-phenylpent-4-enyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1-phenylpent-4-enyl ester IUPAC Name: 1-phenylpent-4-enyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1-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)OC(CCC=C)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(CCC=C)C2=CC=CC=C2

InChI

InChI=1S/C18H20O3S/c1-3-4-10-18(16-8-6-5-7-9-16)21-22(19,20)17-13-11-15(2)12-14-17/h3,5-9,11-14,18H,1,4,10H2,2H3