3-cyanopropyl 1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 3-cyanopropyl 1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 3-cyanopropyl 1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxylic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-methoxyphenyl)sulfonylisonipecotic acid 3-cyanopropyl ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCCCC#N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCCCC#N

InChI

InChI=1S/C17H22N2O5S/c1-23-15-4-6-16(7-5-15)25(21,22)19-11-8-14(9-12-19)17(20)24-13-3-2-10-18/h4-7,14H,2-3,8-9,11-13H2,1H3