4-[2-[3-[(Z)-hydroxyiminomethyl]pyridin-1-ium-1-yl]ethanoylamino]benzoate

Systemtic Name: 4-[2-[3-[(Z)-hydroxyiminomethyl]pyridin-1-ium-1-yl]ethanoylamino]benzoate Openeye Name: 4-[[2-[3-[(Z)-hydroxyiminomethyl]pyridin-1-ium-1-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[3-[(Z)-hydroxyiminomethyl]-1-pyridin-1-iumyl]-1-oxoethyl]amino]benzoate IUPAC Name: 4-[[2-[3-[(Z)-hydroxyiminomethyl]pyridin-1-ium-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[3-[(Z)-hydroximinomethyl]pyridin-1-ium-1-yl]acetyl]amino]benzoate Formula: C15H13N3O4 MolecularWeight: 299.28142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CC(=O)NC2=CC=C(C=C2)C(=O)[O-])C=NO

Isomeric SMILES

C1=CC(=C[N+](=C1)CC(=O)NC2=CC=C(C=C2)C(=O)[O-])/C=N\O

InChI

InChI=1S/C15H13N3O4/c19-14(10-18-7-1-2-11(9-18)8-16-22)17-13-5-3-12(4-6-13)15(20)21/h1-9H,10H2,(H2-,17,19,20,21,22)/b16-8-