ethyl 7-[3-[[(4-ethoxycarbonylphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-fluoranyl-3-oxidanylidene-4H-quinoxaline-2-carboxylate

Systemtic Name: ethyl 7-[3-[[(4-ethoxycarbonylphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-fluoranyl-3-oxidanylidene-4H-quinoxaline-2-carboxylate Openeye Name: ethyl 7-[3-[[(4-ethoxycarbonylphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-fluoro-3-oxo-4H-quinoxaline-2-carboxylate CAS Name: 7-[3-[[[(4-ethoxycarbonylanilino)-oxomethyl]amino]methyl]-1-pyrrolyl]-6-fluoro-3-oxo-4H-quinoxaline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[3-[[(4-ethoxycarbonylphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-fluoro-3-oxo-4H-quinoxaline-2-carboxylate Traditional Name: 7-[3-[[(4-carbethoxyphenyl)carbamoylamino]methyl]pyrrol-1-yl]-6-fluoro-3-keto-4H-quinoxaline-2-carboxylic acid ethyl ester Formula: C26H24FN5O6 MolecularWeight: 521.497063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCC2=CN(C=C2)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)OCC)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCC2=CN(C=C2)C3=C(C=C4C(=C3)N=C(C(=O)N4)C(=O)OCC)F

InChI

InChI=1S/C26H24FN5O6/c1-3-37-24(34)16-5-7-17(8-6-16)29-26(36)28-13-15-9-10-32(14-15)21-12-20-19(11-18(21)27)31-23(33)22(30-20)25(35)38-4-2/h5-12,14H,3-4,13H2,1-2H3,(H,31,33)(H2,28,29,36)