(3S)-N-[2-(azepan-1-ium-1-yl)ethyl]-1-cyclopentyl-N-methyl-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[2-(azepan-1-ium-1-yl)ethyl]-1-cyclopentyl-N-methyl-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: (3S)-N-[2-(azepan-1-ium-1-yl)ethyl]-1-cyclopentyl-N-methyl-6-oxo-piperidine-3-carboxamide CAS Name: (3S)-N-[2-(1-azepan-1-iumyl)ethyl]-1-cyclopentyl-N-methyl-6-oxo-3-piperidinecarboxamide IUPAC Name: (3S)-N-[2-(azepan-1-ium-1-yl)ethyl]-1-cyclopentyl-N-methyl-6-oxopiperidine-3-carboxamide Traditional Name: (3S)-N-[2-(azepan-1-ium-1-yl)ethyl]-1-cyclopentyl-6-keto-N-methyl-nipecotamide Formula: C20H36N3O2+ MolecularWeight: 350.51874

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC[NH+]1CCCCCC1)C(=O)C2CCC(=O)N(C2)C3CCCC3

Isomeric SMILES

CN(CC[NH+]1CCCCCC1)C(=O)[C@H]2CCC(=O)N(C2)C3CCCC3

InChI

InChI=1S/C20H35N3O2/c1-21(14-15-22-12-6-2-3-7-13-22)20(25)17-10-11-19(24)23(16-17)18-8-4-5-9-18/h17-18H,2-16H2,1H3/p+1/t17-/m0/s1