1-(4-methoxy-3-methyl-phenyl)sulfonylpiperidine-4-carbonitrile

Systemtic Name: 1-(4-methoxy-3-methyl-phenyl)sulfonylpiperidine-4-carbonitrile Openeye Name: 1-(4-methoxy-3-methyl-phenyl)sulfonylpiperidine-4-carbonitrile CAS Name: 1-(4-methoxy-3-methylphenyl)sulfonyl-4-piperidinecarbonitrile IUPAC Name: 1-(4-methoxy-3-methylphenyl)sulfonylpiperidine-4-carbonitrile Traditional Name: 1-(4-methoxy-3-methyl-phenyl)sulfonylisonipecotonitrile Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCC(CC2)C#N)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCC(CC2)C#N)OC

InChI

InChI=1S/C14H18N2O3S/c1-11-9-13(3-4-14(11)19-2)20(17,18)16-7-5-12(10-15)6-8-16/h3-4,9,12H,5-8H2,1-2H3