1-(5-chloranyl-2-ethoxy-phenyl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(5-chloranyl-2-ethoxy-phenyl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(5-chloro-2-ethoxy-phenyl)sulfonyl-N-(2-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-(5-chloro-2-ethoxyphenyl)sulfonyl-N-(2-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-chloro-2-ethoxyphenyl)sulfonyl-N-(pyridin-2-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(5-chloro-2-ethoxy-phenyl)sulfonyl-N-(2-pyridylmethyl)isonipecotamide Formula: C20H24ClN3O4S MolecularWeight: 437.94026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C20H24ClN3O4S/c1-2-28-18-7-6-16(21)13-19(18)29(26,27)24-11-8-15(9-12-24)20(25)23-14-17-5-3-4-10-22-17/h3-7,10,13,15H,2,8-9,11-12,14H2,1H3,(H,23,25)