methyl 2-[(4-oxidanidylquinoxalin-4-ium-2-yl)carbonylamino]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[(4-oxidanidylquinoxalin-4-ium-2-yl)carbonylamino]-2-phenyl-ethanoate Openeye Name: methyl 2-[(4-oxidoquinoxalin-4-ium-2-carbonyl)amino]-2-phenyl-acetate CAS Name: 2-[[(4-oxido-2-quinoxalin-4-iumyl)-oxomethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[(4-oxidoquinoxalin-4-ium-2-carbonyl)amino]-2-phenylacetate Traditional Name: 2-[(4-oxidoquinoxalin-4-ium-2-carbonyl)amino]-2-phenyl-acetic acid methyl ester Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3[N+](=C2)[O-]

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3[N+](=C2)[O-]

InChI

InChI=1S/C18H15N3O4/c1-25-18(23)16(12-7-3-2-4-8-12)20-17(22)14-11-21(24)15-10-6-5-9-13(15)19-14/h2-11,16H,1H3,(H,20,22)