1-cyclopentyl-4-oxidanylidene-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-5-piperidin-1-ylcarbonyl-pyridine-3-carboxamide

Systemtic Name: 1-cyclopentyl-4-oxidanylidene-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-5-piperidin-1-ylcarbonyl-pyridine-3-carboxamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-1-cyclopentyl-4-oxo-5-(piperidine-1-carbonyl)pyridine-3-carboxamide CAS Name: 1-cyclopentyl-4-oxo-5-[oxo(1-piperidinyl)methyl]-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-3-pyridinecarboxamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-1-cyclopentyl-4-oxo-5-(piperidine-1-carbonyl)pyridine-3-carboxamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-1-cyclopentyl-4-keto-5-(piperidine-1-carbonyl)nicotinamide Formula: C28H37N4O3+ MolecularWeight: 477.61838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CN(C=C(C2=O)C(=O)NC3CC[NH+](C3)CC4=CC=CC=C4)C5CCCC5

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CN(C=C(C2=O)C(=O)N[C@H]3CC[NH+](C3)CC4=CC=CC=C4)C5CCCC5

InChI

InChI=1S/C28H36N4O3/c33-26-24(27(34)29-22-13-16-30(18-22)17-21-9-3-1-4-10-21)19-32(23-11-5-6-12-23)20-25(26)28(35)31-14-7-2-8-15-31/h1,3-4,9-10,19-20,22-23H,2,5-8,11-18H2,(H,29,34)/p+1/t22-/m0/s1