N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(3-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(3-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(3-acetylphenyl)sulfonyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-4-carboxamide CAS Name: 1-(3-acetylphenyl)sulfonyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-piperidinecarboxamide IUPAC Name: 1-(3-acetylphenyl)sulfonyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine-4-carboxamide Traditional Name: 1-(3-acetylphenyl)sulfonyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)isonipecotamide Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

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