N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(4-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(4-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-acetylphenyl)sulfonyl-N-[2-(1,3-benzodioxol-5-yl)ethyl]piperidine-4-carboxamide CAS Name: 1-(4-acetylphenyl)sulfonyl-N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-acetylphenyl)sulfonyl-N-[2-(1,3-benzodioxol-5-yl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(4-acetylphenyl)sulfonyl-N-homopiperonyl-isonipecotamide Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H26N2O6S/c1-16(26)18-3-5-20(6-4-18)32(28,29)25-12-9-19(10-13-25)23(27)24-11-8-17-2-7-21-22(14-17)31-15-30-21/h2-7,14,19H,8-13,15H2,1H3,(H,24,27)