ethyl 2-(2-piperidin-1-ium-4-yloxyethanoylamino)benzoate

Systemtic Name: ethyl 2-(2-piperidin-1-ium-4-yloxyethanoylamino)benzoate Openeye Name: ethyl 2-[(2-piperidin-1-ium-4-yloxyacetyl)amino]benzoate CAS Name: 2-[[1-oxo-2-(4-piperidin-1-iumyloxy)ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[(2-piperidin-1-ium-4-yloxyacetyl)amino]benzoate Traditional Name: 2-[(2-piperidin-1-ium-4-yloxyacetyl)amino]benzoic acid ethyl ester Formula: C16H23N2O4+ MolecularWeight: 307.36482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)COC2CC[NH2+]CC2

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)COC2CC[NH2+]CC2

InChI

InChI=1S/C16H22N2O4/c1-2-21-16(20)13-5-3-4-6-14(13)18-15(19)11-22-12-7-9-17-10-8-12/h3-6,12,17H,2,7-11H2,1H3,(H,18,19)/p+1