(3S)-1-(1-cyclohexylcarbonylpiperidin-4-yl)-N-cyclopropyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-(1-cyclohexylcarbonylpiperidin-4-yl)-N-cyclopropyl-piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[1-(cyclohexanecarbonyl)-4-piperidyl]-N-cyclopropyl-piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[1-[cyclohexyl(oxo)methyl]-4-piperidinyl]-N-cyclopropyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[1-(cyclohexanecarbonyl)piperidin-4-yl]-N-cyclopropylpiperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[1-(cyclohexanecarbonyl)-4-piperidyl]-N-cyclopropyl-piperidin-1-ium-3-carboxamide Formula: C21H36N3O2+ MolecularWeight: 362.52944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCC(CC2)[NH+]3CCCC(C3)C(=O)NC4CC4

Isomeric SMILES

C1CCC(CC1)C(=O)N2CCC(CC2)[NH+]3CCC[C@@H](C3)C(=O)NC4CC4

InChI

InChI=1S/C21H35N3O2/c25-20(22-18-8-9-18)17-7-4-12-24(15-17)19-10-13-23(14-11-19)21(26)16-5-2-1-3-6-16/h16-19H,1-15H2,(H,22,25)/p+1/t17-/m0/s1