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

Systemtic Name: N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]-6-(oxan-4-ylamino)pyridine-3-carboxamide Openeye Name: N-[[(3R)-1-isobutylpyrrolidin-1-ium-3-yl]methyl]-6-(tetrahydropyran-4-ylamino)pyridine-3-carboxamide CAS Name: N-[[(3R)-1-(2-methylpropyl)-3-pyrrolidin-1-iumyl]methyl]-6-(4-oxanylamino)-3-pyridinecarboxamide IUPAC Name: N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]-6-(oxan-4-ylamino)pyridine-3-carboxamide Traditional Name: N-[[(3R)-1-isobutylpyrrolidin-1-ium-3-yl]methyl]-6-(tetrahydropyran-4-ylamino)nicotinamide Formula: C20H33N4O2+ MolecularWeight: 361.50162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCC(C1)CNC(=O)C2=CN=C(C=C2)NC3CCOCC3

Isomeric SMILES

CC(C)C[NH+]1CC[C@@H](C1)CNC(=O)C2=CN=C(C=C2)NC3CCOCC3

InChI

InChI=1S/C20H32N4O2/c1-15(2)13-24-8-5-16(14-24)11-22-20(25)17-3-4-19(21-12-17)23-18-6-9-26-10-7-18/h3-4,12,15-16,18H,5-11,13-14H2,1-2H3,(H,21,23)(H,22,25)/p+1/t16-/m1/s1