N-(1,3-benzodioxol-5-ylmethyl)-1-(3,5-dimethylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(3,5-dimethylpiperidin-1-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(3,5-dimethyl-1-piperidyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide Traditional Name: 1-(3,5-dimethylpiperidino)sulfonyl-N-piperonyl-nipecotamide Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H31N3O5S/c1-15-8-16(2)12-24(11-15)30(26,27)23-7-3-4-18(13-23)21(25)22-10-17-5-6-19-20(9-17)29-14-28-19/h5-6,9,15-16,18H,3-4,7-8,10-14H2,1-2H3,(H,22,25)