3-ethoxy-7-[5-[(2-ethoxycarbonylphenyl)carbamoyloxymethyl]-1H-imidazol-2-yl]-6-nitro-quinoxaline-2-carboxylic acid

Systemtic Name: 3-ethoxy-7-[5-[(2-ethoxycarbonylphenyl)carbamoyloxymethyl]-1H-imidazol-2-yl]-6-nitro-quinoxaline-2-carboxylic acid Openeye Name: 3-ethoxy-7-[5-[(2-ethoxycarbonylphenyl)carbamoyloxymethyl]-1H-imidazol-2-yl]-6-nitro-quinoxaline-2-carboxylic acid CAS Name: 3-ethoxy-7-[5-[[(2-ethoxycarbonylanilino)-oxomethoxy]methyl]-1H-imidazol-2-yl]-6-nitro-2-quinoxalinecarboxylic acid IUPAC Name: 3-ethoxy-7-[5-[(2-ethoxycarbonylphenyl)carbamoyloxymethyl]-1H-imidazol-2-yl]-6-nitroquinoxaline-2-carboxylic acid Traditional Name: 7-[5-[(2-carbethoxyphenyl)carbamoyloxymethyl]-1H-imidazol-2-yl]-3-ethoxy-6-nitro-quinoxaline-2-carboxylic acid Formula: C25H22N6O9 MolecularWeight: 550.47698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=C(C=C(C(=C2)[N+](=O)[O-])C3=NC=C(N3)COC(=O)NC4=CC=CC=C4C(=O)OCC)N=C1C(=O)O

Isomeric SMILES

CCOC1=NC2=C(C=C(C(=C2)[N+](=O)[O-])C3=NC=C(N3)COC(=O)NC4=CC=CC=C4C(=O)OCC)N=C1C(=O)O

InChI

InChI=1S/C25H22N6O9/c1-3-38-22-20(23(32)33)28-17-9-15(19(31(36)37)10-18(17)29-22)21-26-11-13(27-21)12-40-25(35)30-16-8-6-5-7-14(16)24(34)39-4-2/h5-11H,3-4,12H2,1-2H3,(H,26,27)(H,30,35)(H,32,33)