ethyl 4-[(3-methoxyphenyl)methyl]-1-[(2R)-1-(4-methylpyridin-2-yl)propan-2-yl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 4-[(3-methoxyphenyl)methyl]-1-[(2R)-1-(4-methylpyridin-2-yl)propan-2-yl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 4-[(3-methoxyphenyl)methyl]-1-[(1R)-1-methyl-2-(4-methyl-2-pyridyl)ethyl]piperidin-1-ium-4-carboxylate CAS Name: 4-[(3-methoxyphenyl)methyl]-1-[(2R)-1-(4-methyl-2-pyridinyl)propan-2-yl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-methoxyphenyl)methyl]-1-[(2R)-1-(4-methylpyridin-2-yl)propan-2-yl]piperidin-1-ium-4-carboxylate Traditional Name: 4-m-anisyl-1-[(1R)-1-methyl-2-(4-methyl-2-pyridyl)ethyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C25H35N2O3+ MolecularWeight: 411.557

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)C(C)CC2=NC=CC(=C2)C)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)[C@H](C)CC2=NC=CC(=C2)C)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C25H34N2O3/c1-5-30-24(28)25(18-21-7-6-8-23(17-21)29-4)10-13-27(14-11-25)20(3)16-22-15-19(2)9-12-26-22/h6-9,12,15,17,20H,5,10-11,13-14,16,18H2,1-4H3/p+1/t20-/m1/s1