4-(4-cyanophenyl)butyl phenylmethanesulfonate

Systemtic Name: 4-(4-cyanophenyl)butyl phenylmethanesulfonate Openeye Name: 4-(4-cyanophenyl)butyl phenylmethanesulfonate CAS Name: phenylmethanesulfonic acid 4-(4-cyanophenyl)butyl ester IUPAC Name: 4-(4-cyanophenyl)butyl phenylmethanesulfonate Traditional Name: phenylmethanesulfonic acid 4-(4-cyanophenyl)butyl ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)OCCCCC2=CC=C(C=C2)C#N

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)OCCCCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H19NO3S/c19-14-17-11-9-16(10-12-17)6-4-5-13-22-23(20,21)15-18-7-2-1-3-8-18/h1-3,7-12H,4-6,13,15H2