[4-[(E)-3-oxidanylprop-1-enyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-[(E)-3-oxidanylprop-1-enyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [4-[(E)-3-hydroxyprop-1-enyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-[(E)-3-hydroxyprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-hydroxyprop-1-enyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-[(E)-3-hydroxyprop-1-enyl]phenyl] ester Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=CCO

Isomeric SMILES

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

InChI

InChI=1S/C16H16O4S/c1-13-4-10-16(11-5-13)21(18,19)20-15-8-6-14(7-9-15)3-2-12-17/h2-11,17H,12H2,1H3/b3-2+