2-phenoxyethyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: 2-phenoxyethyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Openeye Name: 2-phenoxyethyl 1-(3-pyridylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(3-pyridinylsulfonyl)-4-piperidinecarboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 1-pyridin-3-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-pyridylsulfonyl)isonipecotic acid 2-phenoxyethyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCCOC2=CC=CC=C2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)OCCOC2=CC=CC=C2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H22N2O5S/c22-19(26-14-13-25-17-5-2-1-3-6-17)16-8-11-21(12-9-16)27(23,24)18-7-4-10-20-15-18/h1-7,10,15-16H,8-9,11-14H2