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

Systemtic Name: methyl 2-[(3-azanyl-2-phenyl-quinolin-4-yl)carbonylamino]-2-(1-oxidanidylpyridin-1-ium-2-yl)ethanoate Openeye Name: methyl 2-[(3-amino-2-phenyl-quinoline-4-carbonyl)amino]-2-(1-oxidopyridin-1-ium-2-yl)acetate CAS Name: 2-[[(3-amino-2-phenyl-4-quinolinyl)-oxomethyl]amino]-2-(1-oxido-2-pyridin-1-iumyl)acetic acid methyl ester IUPAC Name: methyl 2-[(3-amino-2-phenylquinoline-4-carbonyl)amino]-2-(1-oxidopyridin-1-ium-2-yl)acetate Traditional Name: 2-[(3-amino-2-phenyl-quinoline-4-carbonyl)amino]-2-(1-oxidopyridin-1-ium-2-yl)acetic acid methyl ester Formula: C24H20N4O4 MolecularWeight: 428.44

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=[N+]1[O-])NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)N

Isomeric SMILES

COC(=O)C(C1=CC=CC=[N+]1[O-])NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)N

InChI

InChI=1S/C24H20N4O4/c1-32-24(30)22(18-13-7-8-14-28(18)31)27-23(29)19-16-11-5-6-12-17(16)26-21(20(19)25)15-9-3-2-4-10-15/h2-14,22H,25H2,1H3,(H,27,29)