1-methyl-5-[(3-nitro-5-pyridin-3-yloxy-phenyl)carbamoyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-methyl-5-[(3-nitro-5-pyridin-3-yloxy-phenyl)carbamoyl]pyrazole-4-carboxylic acid Openeye Name: 1-methyl-5-[[3-nitro-5-(3-pyridyloxy)phenyl]carbamoyl]pyrazole-4-carboxylic acid CAS Name: 1-methyl-5-[[3-nitro-5-(3-pyridinyloxy)anilino]-oxomethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-5-[(3-nitro-5-pyridin-3-yloxyphenyl)carbamoyl]pyrazole-4-carboxylic acid Traditional Name: 1-methyl-5-[[3-nitro-5-(3-pyridyloxy)phenyl]carbamoyl]pyrazole-4-carboxylic acid Formula: C17H13N5O6 MolecularWeight: 383.31502

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=CC(=CC(=C2)OC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=CC(=CC(=C2)OC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O6/c1-21-15(14(9-19-21)17(24)25)16(23)20-10-5-11(22(26)27)7-13(6-10)28-12-3-2-4-18-8-12/h2-9H,1H3,(H,20,23)(H,24,25)