2-[4-[(phenylmethyl)carbamoyl]pyridin-1-ium-1-yl]ethanoic acid

Systemtic Name: 2-[4-[(phenylmethyl)carbamoyl]pyridin-1-ium-1-yl]ethanoic acid Openeye Name: 2-[4-(benzylcarbamoyl)pyridin-1-ium-1-yl]acetic acid CAS Name: 2-[4-[oxo-[(phenylmethyl)amino]methyl]-1-pyridin-1-iumyl]acetic acid IUPAC Name: 2-[4-(benzylcarbamoyl)pyridin-1-ium-1-yl]acetic acid Traditional Name: 2-[4-(benzylcarbamoyl)pyridin-1-ium-1-yl]acetic acid Formula: C15H15N2O3+ MolecularWeight: 271.2912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC=[N+](C=C2)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC=[N+](C=C2)CC(=O)O

InChI

InChI=1S/C15H14N2O3/c18-14(19)11-17-8-6-13(7-9-17)15(20)16-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H-,16,18,19,20)/p+1