3-ethoxy-7-[3-[(4-ethoxycarbonylphenyl)carbamoyloxymethyl]-4-oxidanylidene-pyridin-1-yl]-6-nitro-quinoxaline-2-carboxylic acid

Systemtic Name: 3-ethoxy-7-[3-[(4-ethoxycarbonylphenyl)carbamoyloxymethyl]-4-oxidanylidene-pyridin-1-yl]-6-nitro-quinoxaline-2-carboxylic acid Openeye Name: 3-ethoxy-7-[3-[(4-ethoxycarbonylphenyl)carbamoyloxymethyl]-4-oxo-1-pyridyl]-6-nitro-quinoxaline-2-carboxylic acid CAS Name: 3-ethoxy-7-[3-[[(4-ethoxycarbonylanilino)-oxomethoxy]methyl]-4-oxo-1-pyridinyl]-6-nitro-2-quinoxalinecarboxylic acid IUPAC Name: 3-ethoxy-7-[3-[(4-ethoxycarbonylphenyl)carbamoyloxymethyl]-4-oxopyridin-1-yl]-6-nitroquinoxaline-2-carboxylic acid Traditional Name: 7-[3-[(4-carbethoxyphenyl)carbamoyloxymethyl]-4-keto-1-pyridyl]-3-ethoxy-6-nitro-quinoxaline-2-carboxylic acid Formula: C27H23N5O10 MolecularWeight: 577.49902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC2=CC(=C(C=C2N=C1C(=O)O)N3C=CC(=O)C(=C3)COC(=O)NC4=CC=C(C=C4)C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=NC2=CC(=C(C=C2N=C1C(=O)O)N3C=CC(=O)C(=C3)COC(=O)NC4=CC=C(C=C4)C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C27H23N5O10/c1-3-40-24-23(25(34)35)29-18-11-20(21(32(38)39)12-19(18)30-24)31-10-9-22(33)16(13-31)14-42-27(37)28-17-7-5-15(6-8-17)26(36)41-4-2/h5-13H,3-4,14H2,1-2H3,(H,28,37)(H,34,35)