[cyano(phenyl)methyl] benzenesulfonate

Systemtic Name: [cyano(phenyl)methyl] benzenesulfonate Openeye Name: [cyano(phenyl)methyl] benzenesulfonate CAS Name: benzenesulfonic acid [cyano(phenyl)methyl] ester IUPAC Name: [cyano(phenyl)methyl] benzenesulfonate Traditional Name: benzenesulfonic acid [cyano(phenyl)methyl] ester Formula: C14H11NO3S MolecularWeight: 273.30704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)OS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)OS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H11NO3S/c15-11-14(12-7-3-1-4-8-12)18-19(16,17)13-9-5-2-6-10-13/h1-10,14H