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

Systemtic Name: N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]-6-pyrrolidin-1-yl-pyridine-3-carboxamide Openeye Name: N-[[(3R)-1-isobutylpyrrolidin-1-ium-3-yl]methyl]-6-pyrrolidin-1-yl-pyridine-3-carboxamide CAS Name: N-[[(3R)-1-(2-methylpropyl)-3-pyrrolidin-1-iumyl]methyl]-6-(1-pyrrolidinyl)-3-pyridinecarboxamide IUPAC Name: N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]-6-pyrrolidin-1-ylpyridine-3-carboxamide Traditional Name: N-[[(3R)-1-isobutylpyrrolidin-1-ium-3-yl]methyl]-6-pyrrolidino-nicotinamide Formula: C19H31N4O+ MolecularWeight: 331.47564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCC(C1)CNC(=O)C2=CN=C(C=C2)N3CCCC3

Isomeric SMILES

CC(C)C[NH+]1CC[C@@H](C1)CNC(=O)C2=CN=C(C=C2)N3CCCC3

InChI

InChI=1S/C19H30N4O/c1-15(2)13-22-10-7-16(14-22)11-21-19(24)17-5-6-18(20-12-17)23-8-3-4-9-23/h5-6,12,15-16H,3-4,7-11,13-14H2,1-2H3,(H,21,24)/p+1/t16-/m1/s1