1-(phenylcarbamoyloxy)propyl 1-(aminomethyl)pyridin-1-ium-2-carboxylate

Systemtic Name: 1-(phenylcarbamoyloxy)propyl 1-(aminomethyl)pyridin-1-ium-2-carboxylate Openeye Name: 1-(phenylcarbamoyloxy)propyl 1-(aminomethyl)pyridin-1-ium-2-carboxylate CAS Name: 1-(aminomethyl)-2-pyridin-1-iumcarboxylic acid 1-[anilino(oxo)methoxy]propyl ester IUPAC Name: 1-(phenylcarbamoyloxy)propyl 1-(aminomethyl)pyridin-1-ium-2-carboxylate Traditional Name: 1-(aminomethyl)pyridin-1-ium-2-carboxylic acid 1-(phenylcarbamoyloxy)propyl ester Formula: C17H20N3O4+ MolecularWeight: 330.3584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OC(=O)C1=CC=CC=[N+]1CN)OC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCC(OC(=O)C1=CC=CC=[N+]1CN)OC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C17H19N3O4/c1-2-15(24-17(22)19-13-8-4-3-5-9-13)23-16(21)14-10-6-7-11-20(14)12-18/h3-11,15H,2,12,18H2,1H3/p+1