N-[2-(3-chlorophenyl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-(3-chlorophenyl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[2-(3-chlorophenyl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(3-chlorophenyl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(3-chlorophenyl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[2-(3-chlorophenyl)ethyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)isonipecotamide Formula: C23H27ClN2O5S MolecularWeight: 478.98888

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NCCC4=CC(=CC=C4)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NCCC4=CC(=CC=C4)Cl)OC1

InChI

InChI=1S/C23H27ClN2O5S/c24-19-4-1-3-17(15-19)7-10-25-23(27)18-8-11-26(12-9-18)32(28,29)20-5-6-21-22(16-20)31-14-2-13-30-21/h1,3-6,15-16,18H,2,7-14H2,(H,25,27)