1-naphthalen-2-ylsulfonyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-naphthalen-2-ylsulfonyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(2-naphthylsulfonyl)-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]piperidine-4-carboxamide CAS Name: 1-(2-naphthalenylsulfonyl)-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-naphthalen-2-ylsulfonyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(2-naphthylsulfonyl)-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]isonipecotamide Formula: C28H40N3O3S+ MolecularWeight: 498.7005

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)[NH+]5CCCCC5

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)[NH+]5CCCCC5

InChI

InChI=1S/C28H39N3O3S/c32-27(29-22-28(15-5-1-6-16-28)30-17-7-2-8-18-30)24-13-19-31(20-14-24)35(33,34)26-12-11-23-9-3-4-10-25(23)21-26/h3-4,9-12,21,24H,1-2,5-8,13-20,22H2,(H,29,32)/p+1