7-[3-[[(4-carboxyphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-methyl-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid

Systemtic Name: 7-[3-[[(4-carboxyphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-methyl-3-oxidanylidene-4H-quinoxaline-2-carboxylic acid Openeye Name: 7-[3-[[(4-carboxyphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-methyl-3-oxo-4H-quinoxaline-2-carboxylic acid CAS Name: 7-[3-[[[(4-carboxyanilino)-oxomethyl]amino]methyl]-1-pyrrolyl]-6-methyl-3-oxo-4H-quinoxaline-2-carboxylic acid IUPAC Name: 7-[3-[[(4-carboxyphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-methyl-3-oxo-4H-quinoxaline-2-carboxylic acid Traditional Name: 7-[3-[[(4-carboxyphenyl)carbamoylamino]methyl]pyrrol-1-yl]-3-keto-6-methyl-4H-quinoxaline-2-carboxylic acid Formula: C23H19N5O6 MolecularWeight: 461.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1N3C=CC(=C3)CNC(=O)NC4=CC=C(C=C4)C(=O)O)N=C(C(=O)N2)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1N3C=CC(=C3)CNC(=O)NC4=CC=C(C=C4)C(=O)O)N=C(C(=O)N2)C(=O)O

InChI

InChI=1S/C23H19N5O6/c1-12-8-16-17(26-19(22(32)33)20(29)27-16)9-18(12)28-7-6-13(11-28)10-24-23(34)25-15-4-2-14(3-5-15)21(30)31/h2-9,11H,10H2,1H3,(H,27,29)(H,30,31)(H,32,33)(H2,24,25,34)