1-(cyclohexylmethyl)-N5-ethyl-4-oxidanylidene-N3-(2-pyrrolidin-1-ium-1-ylethyl)pyridine-3,5-dicarboxamide

Systemtic Name: 1-(cyclohexylmethyl)-N5-ethyl-4-oxidanylidene-N3-(2-pyrrolidin-1-ium-1-ylethyl)pyridine-3,5-dicarboxamide Openeye Name: 1-(cyclohexylmethyl)-N5-ethyl-4-oxo-N3-(2-pyrrolidin-1-ium-1-ylethyl)pyridine-3,5-dicarboxamide CAS Name: 1-(cyclohexylmethyl)-N5-ethyl-4-oxo-N3-[2-(1-pyrrolidin-1-iumyl)ethyl]pyridine-3,5-dicarboxamide IUPAC Name: 1-(cyclohexylmethyl)-5-N-ethyl-4-oxo-3-N-(2-pyrrolidin-1-ium-1-ylethyl)pyridine-3,5-dicarboxamide Traditional Name: 1-(cyclohexylmethyl)-N'-ethyl-4-keto-N-(2-pyrrolidin-1-ium-1-ylethyl)dinicotinamide Formula: C22H35N4O3+ MolecularWeight: 403.5383

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CN(C=C(C1=O)C(=O)NCC[NH+]2CCCC2)CC3CCCCC3

Isomeric SMILES

CCNC(=O)C1=CN(C=C(C1=O)C(=O)NCC[NH+]2CCCC2)CC3CCCCC3

InChI

InChI=1S/C22H34N4O3/c1-2-23-21(28)18-15-26(14-17-8-4-3-5-9-17)16-19(20(18)27)22(29)24-10-13-25-11-6-7-12-25/h15-17H,2-14H2,1H3,(H,23,28)(H,24,29)/p+1