methyl 2-(1-oxidanidylpyridin-1-ium-3-yl)-2-[(3-oxidanyl-2-phenyl-quinolin-4-yl)carbonylamino]ethanoate

Systemtic Name: methyl 2-(1-oxidanidylpyridin-1-ium-3-yl)-2-[(3-oxidanyl-2-phenyl-quinolin-4-yl)carbonylamino]ethanoate Openeye Name: methyl 2-[(3-hydroxy-2-phenyl-quinoline-4-carbonyl)amino]-2-(1-oxidopyridin-1-ium-3-yl)acetate CAS Name: 2-[[(3-hydroxy-2-phenyl-4-quinolinyl)-oxomethyl]amino]-2-(1-oxido-3-pyridin-1-iumyl)acetic acid methyl ester IUPAC Name: methyl 2-[(3-hydroxy-2-phenylquinoline-4-carbonyl)amino]-2-(1-oxidopyridin-1-ium-3-yl)acetate Traditional Name: 2-[(3-hydroxy-2-phenyl-quinoline-4-carbonyl)amino]-2-(1-oxidopyridin-1-ium-3-yl)acetic acid methyl ester Formula: C24H19N3O5 MolecularWeight: 429.42476

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=C[N+](=CC=C1)[O-])NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)O

Isomeric SMILES

COC(=O)C(C1=C[N+](=CC=C1)[O-])NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)O

InChI

InChI=1S/C24H19N3O5/c1-32-24(30)21(16-10-7-13-27(31)14-16)26-23(29)19-17-11-5-6-12-18(17)25-20(22(19)28)15-8-3-2-4-9-15/h2-14,21,28H,1H3,(H,26,29)