ethyl 4-(cyclopropylmethyl)-1-[(2R)-1-pyridin-3-ylpropan-2-yl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 4-(cyclopropylmethyl)-1-[(2R)-1-pyridin-3-ylpropan-2-yl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 4-(cyclopropylmethyl)-1-[(1R)-1-methyl-2-(3-pyridyl)ethyl]piperidin-1-ium-4-carboxylate CAS Name: 4-(cyclopropylmethyl)-1-[(2R)-1-(3-pyridinyl)propan-2-yl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-(cyclopropylmethyl)-1-[(2R)-1-pyridin-3-ylpropan-2-yl]piperidin-1-ium-4-carboxylate Traditional Name: 4-(cyclopropylmethyl)-1-[(1R)-1-methyl-2-(3-pyridyl)ethyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C20H31N2O2+ MolecularWeight: 331.47234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)C(C)CC2=CN=CC=C2)CC3CC3

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)[C@H](C)CC2=CN=CC=C2)CC3CC3

InChI

InChI=1S/C20H30N2O2/c1-3-24-19(23)20(14-17-6-7-17)8-11-22(12-9-20)16(2)13-18-5-4-10-21-15-18/h4-5,10,15-17H,3,6-9,11-14H2,1-2H3/p+1/t16-/m1/s1