ethyl 1-[(4-dimethylaminophenyl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(4-dimethylaminophenyl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(4-dimethylaminophenyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(4-dimethylaminophenyl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-dimethylaminophenyl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[4-(dimethylamino)benzyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H27N2O2+ MolecularWeight: 291.40848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C17H26N2O2/c1-4-21-17(20)15-9-11-19(12-10-15)13-14-5-7-16(8-6-14)18(2)3/h5-8,15H,4,9-13H2,1-3H3/p+1