N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-1-propylsulfonyl-nipecotamide Formula: C19H28N2O5S MolecularWeight: 396.50102

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC(C)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC(C)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H28N2O5S/c1-3-11-27(23,24)21-8-4-5-16(13-21)19(22)20-14(2)15-6-7-17-18(12-15)26-10-9-25-17/h6-7,12,14,16H,3-5,8-11,13H2,1-2H3,(H,20,22)