phenethyl 4-propylbenzenesulfonate

Systemtic Name: phenethyl 4-propylbenzenesulfonate Openeye Name: phenethyl 4-propylbenzenesulfonate CAS Name: 4-propylbenzenesulfonic acid phenethyl ester IUPAC Name: phenethyl 4-propylbenzenesulfonate Traditional Name: 4-propylbenzenesulfonic acid phenethyl ester Formula: C17H20O3S MolecularWeight: 304.4039

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC=CC=C2

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC=CC=C2

InChI

InChI=1S/C17H20O3S/c1-2-6-15-9-11-17(12-10-15)21(18,19)20-14-13-16-7-4-3-5-8-16/h3-5,7-12H,2,6,13-14H2,1H3