1-[(3S)-1-cyclopentyl-6-oxidanylidene-piperidin-3-yl]carbonyl-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-[(3S)-1-cyclopentyl-6-oxidanylidene-piperidin-3-yl]carbonyl-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide Openeye Name: 1-[(3S)-1-cyclopentyl-6-oxo-piperidine-3-carbonyl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide CAS Name: 1-[[(3S)-1-cyclopentyl-6-oxo-3-piperidinyl]-oxomethyl]-4-(1-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-[(3S)-1-cyclopentyl-6-oxopiperidine-3-carbonyl]-4-piperidin-1-ium-1-ylpiperidine-4-carboxamide Traditional Name: 1-[(3S)-1-cyclopentyl-6-keto-nipecotoyl]-4-piperidin-1-ium-1-yl-isonipecotamide Formula: C22H37N4O3+ MolecularWeight: 405.55418

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CCN(CC2)C(=O)C3CCC(=O)N(C3)C4CCCC4)C(=O)N

Isomeric SMILES

C1CC[NH+](CC1)C2(CCN(CC2)C(=O)[C@H]3CCC(=O)N(C3)C4CCCC4)C(=O)N

InChI

InChI=1S/C22H36N4O3/c23-21(29)22(25-12-4-1-5-13-25)10-14-24(15-11-22)20(28)17-8-9-19(27)26(16-17)18-6-2-3-7-18/h17-18H,1-16H2,(H2,23,29)/p+1/t17-/m0/s1