3-(4-cyanophenyl)propyl 4-methylbenzenesulfonate

Systemtic Name: 3-(4-cyanophenyl)propyl 4-methylbenzenesulfonate Openeye Name: 3-(4-cyanophenyl)propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-(4-cyanophenyl)propyl ester IUPAC Name: 3-(4-cyanophenyl)propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(4-cyanophenyl)propyl ester Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H17NO3S/c1-14-4-10-17(11-5-14)22(19,20)21-12-2-3-15-6-8-16(13-18)9-7-15/h4-11H,2-3,12H2,1H3