2-[(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-ylcarbonylamino)carbamoyl]benzoic acid

Systemtic Name: 2-[(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-ylcarbonylamino)carbamoyl]benzoic acid Openeye Name: 2-[(1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbonylamino)carbamoyl]benzoic acid CAS Name: 2-[oxo-[[oxo(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)methyl]hydrazo]methyl]benzoic acid IUPAC Name: 2-[(1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbonylamino)carbamoyl]benzoic acid Traditional Name: 2-[(1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbonylamino)carbamoyl]benzoic acid Formula: C15H14N4O4 MolecularWeight: 314.29606

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)NN=C2C(=O)NNC(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CC2=C(C1)NN=C2C(=O)NNC(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C15H14N4O4/c20-13(8-4-1-2-5-9(8)15(22)23)18-19-14(21)12-10-6-3-7-11(10)16-17-12/h1-2,4-5H,3,6-7H2,(H,16,17)(H,18,20)(H,19,21)(H,22,23)