4-phenylbutyl 4-methylbenzenesulfonate

Systemtic Name: 4-phenylbutyl 4-methylbenzenesulfonate Openeye Name: 4-phenylbutyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-phenylbutyl ester IUPAC Name: 4-phenylbutyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4-phenylbutyl ester Formula: C17H20O3S MolecularWeight: 304.4039

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCC2=CC=CC=C2

InChI

InChI=1S/C17H20O3S/c1-15-10-12-17(13-11-15)21(18,19)20-14-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,10-13H,5-6,9,14H2,1H3