1-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-yl)piperidine-3-carboxamide

Systemtic Name: 1-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-yl)piperidine-3-carboxamide Openeye Name: 1-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-yl)piperidine-3-carboxamide CAS Name: 1-(1-azepanylsulfonyl)-N-(1,3-benzodioxol-5-yl)-3-piperidinecarboxamide IUPAC Name: 1-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-yl)piperidine-3-carboxamide Traditional Name: 1-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-yl)nipecotamide Formula: C19H27N3O5S MolecularWeight: 409.49978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H27N3O5S/c23-19(20-16-7-8-17-18(12-16)27-14-26-17)15-6-5-11-22(13-15)28(24,25)21-9-3-1-2-4-10-21/h7-8,12,15H,1-6,9-11,13-14H2,(H,20,23)