[(3R)-3-[1-(2-methylpropyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [(3R)-3-[1-(2-methylpropyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]-pyridin-4-yl-methanone Openeye Name: [(3R)-3-(1-isobutylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]-(4-pyridyl)methanone CAS Name: [(3R)-3-[1-(2-methylpropyl)-4-piperidin-1-iumyl]-1-pyrrolidinyl]-pyridin-4-ylmethanone IUPAC Name: [(3R)-3-[1-(2-methylpropyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]-pyridin-4-ylmethanone Traditional Name: [(3R)-3-(1-isobutylpiperidin-1-ium-4-yl)pyrrolidino]-(4-pyridyl)methanone Formula: C19H30N3O+ MolecularWeight: 316.461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCC(CC1)C2CCN(C2)C(=O)C3=CC=NC=C3

Isomeric SMILES

CC(C)C[NH+]1CCC(CC1)[C@H]2CCN(C2)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C19H29N3O/c1-15(2)13-21-10-5-16(6-11-21)18-7-12-22(14-18)19(23)17-3-8-20-9-4-17/h3-4,8-9,15-16,18H,5-7,10-14H2,1-2H3/p+1/t18-/m0/s1