cyanomethyl 4-(3-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: cyanomethyl 4-(3-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: cyanomethyl 4-[(3-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(3-methyl-1-piperidinyl)sulfonyl]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 4-(3-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(3-methylpiperidino)sulfonylbenzoic acid cyanomethyl ester Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC#N

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC#N

InChI

InChI=1S/C15H18N2O4S/c1-12-3-2-9-17(11-12)22(19,20)14-6-4-13(5-7-14)15(18)21-10-8-16/h4-7,12H,2-3,9-11H2,1H3