1-methyl-5-[(4-piperidin-1-yl-2,1,3-benzoxadiazol-7-yl)carbamoyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-methyl-5-[(4-piperidin-1-yl-2,1,3-benzoxadiazol-7-yl)carbamoyl]pyrazole-4-carboxylic acid Openeye Name: 1-methyl-5-[[4-(1-piperidyl)-2,1,3-benzoxadiazol-7-yl]carbamoyl]pyrazole-4-carboxylic acid CAS Name: 1-methyl-5-[oxo-[[4-(1-piperidinyl)-2,1,3-benzoxadiazol-7-yl]amino]methyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-5-[(4-piperidin-1-yl-2,1,3-benzoxadiazol-7-yl)carbamoyl]pyrazole-4-carboxylic acid Traditional Name: 1-methyl-5-[(7-piperidinobenzofurazan-4-yl)carbamoyl]pyrazole-4-carboxylic acid Formula: C17H18N6O4 MolecularWeight: 370.36262

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=CC=C(C3=NON=C23)N4CCCCC4

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=CC=C(C3=NON=C23)N4CCCCC4

InChI

InChI=1S/C17H18N6O4/c1-22-15(10(9-18-22)17(25)26)16(24)19-11-5-6-12(14-13(11)20-27-21-14)23-7-3-2-4-8-23/h5-6,9H,2-4,7-8H2,1H3,(H,19,24)(H,25,26)