N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]-6-(4-propan-2-ylpiperazin-4-ium-1-yl)pyridine-3-carboxamide

Systemtic Name: N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]-6-(4-propan-2-ylpiperazin-4-ium-1-yl)pyridine-3-carboxamide Openeye Name: N-[[(3R)-1-isobutylpyrrolidin-1-ium-3-yl]methyl]-6-(4-isopropylpiperazin-4-ium-1-yl)pyridine-3-carboxamide CAS Name: N-[[(3R)-1-(2-methylpropyl)-3-pyrrolidin-1-iumyl]methyl]-6-(4-propan-2-yl-1-piperazin-4-iumyl)-3-pyridinecarboxamide IUPAC Name: N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]-6-(4-propan-2-ylpiperazin-4-ium-1-yl)pyridine-3-carboxamide Traditional Name: N-[[(3R)-1-isobutylpyrrolidin-1-ium-3-yl]methyl]-6-(4-isopropylpiperazin-4-ium-1-yl)nicotinamide Formula: C22H39N5O+2 MolecularWeight: 389.57796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCC(C1)CNC(=O)C2=CN=C(C=C2)N3CC[NH+](CC3)C(C)C

Isomeric SMILES

CC(C)C[NH+]1CC[C@@H](C1)CNC(=O)C2=CN=C(C=C2)N3CC[NH+](CC3)C(C)C

InChI

InChI=1S/C22H37N5O/c1-17(2)15-25-8-7-19(16-25)13-24-22(28)20-5-6-21(23-14-20)27-11-9-26(10-12-27)18(3)4/h5-6,14,17-19H,7-13,15-16H2,1-4H3,(H,24,28)/p+2/t19-/m1/s1