1-(4-aminophenyl)-1-ethyl-piperidin-1-ium-2-carboxylate

Systemtic Name: 1-(4-aminophenyl)-1-ethyl-piperidin-1-ium-2-carboxylate Openeye Name: 1-(4-aminophenyl)-1-ethyl-piperidin-1-ium-2-carboxylate CAS Name: 1-(4-aminophenyl)-1-ethyl-2-piperidin-1-iumcarboxylate IUPAC Name: 1-(4-aminophenyl)-1-ethylpiperidin-1-ium-2-carboxylate Traditional Name: 1-(4-aminophenyl)-1-ethyl-piperidin-1-ium-2-carboxylate Formula: C14H20N2O2 MolecularWeight: 248.3208

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CCCCC1C(=O)[O-])C2=CC=C(C=C2)N

Isomeric SMILES

CC[N+]1(CCCCC1C(=O)[O-])C2=CC=C(C=C2)N

InChI

InChI=1S/C14H20N2O2/c1-2-16(12-8-6-11(15)7-9-12)10-4-3-5-13(16)14(17)18/h6-9,13H,2-5,10,15H2,1H3