N-(1,3-benzodioxol-5-ylmethyl)-1-(5-chloranyl-2-ethoxy-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-chloranyl-2-ethoxy-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-chloro-2-ethoxy-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-chloro-2-ethoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(5-chloro-2-ethoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-(5-chloro-2-ethoxy-phenyl)sulfonyl-N-piperonyl-isonipecotamide Formula: C22H25ClN2O6S MolecularWeight: 480.9617

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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=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H25ClN2O6S/c1-2-29-19-6-4-17(23)12-21(19)32(27,28)25-9-7-16(8-10-25)22(26)24-13-15-3-5-18-20(11-15)31-14-30-18/h3-6,11-12,16H,2,7-10,13-14H2,1H3,(H,24,26)