N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: N-cyclopentyl-1-esyl-N-piperonyl-isonipecotamide Formula: C21H30N2O5S MolecularWeight: 422.5383

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)N(CC2=CC3=C(C=C2)OCO3)C4CCCC4

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)N(CC2=CC3=C(C=C2)OCO3)C4CCCC4

InChI

InChI=1S/C21H30N2O5S/c1-2-29(25,26)22-11-9-17(10-12-22)21(24)23(18-5-3-4-6-18)14-16-7-8-19-20(13-16)28-15-27-19/h7-8,13,17-18H,2-6,9-12,14-15H2,1H3