dimethyl 5-[(pyridin-4-ylcarbonylamino)carbamoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(pyridin-4-ylcarbonylamino)carbamoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(pyridine-4-carbonylamino)carbamoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-[[oxo(pyridin-4-yl)methyl]hydrazo]methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(pyridine-4-carbonylamino)carbamoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-(isonicotinamidocarbamoylamino)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C17H16N4O6 MolecularWeight: 372.33214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)NNC(=O)C2=CC=NC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)NNC(=O)C2=CC=NC=C2)C(=O)OC

InChI

InChI=1S/C17H16N4O6/c1-26-15(23)11-7-12(16(24)27-2)9-13(8-11)19-17(25)21-20-14(22)10-3-5-18-6-4-10/h3-9H,1-2H3,(H,20,22)(H2,19,21,25)