4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]-2-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]-2-methyl-pyrazole-3-carboxylic acid Openeye Name: 4-[6-(1,3-dioxoisoindolin-2-yl)hexanoylamino]-2-methyl-pyrazole-3-carboxylic acid CAS Name: 4-[[6-(1,3-dioxo-2-isoindolyl)-1-oxohexyl]amino]-2-methyl-3-pyrazolecarboxylic acid IUPAC Name: 4-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]-2-methylpyrazole-3-carboxylic acid Traditional Name: 2-methyl-4-(6-phthalimidohexanoylamino)pyrazole-3-carboxylic acid Formula: C19H20N4O5 MolecularWeight: 384.3859

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O)C(=O)O

Isomeric SMILES

CN1C(=C(C=N1)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O)C(=O)O

InChI

InChI=1S/C19H20N4O5/c1-22-16(19(27)28)14(11-20-22)21-15(24)9-3-2-6-10-23-17(25)12-7-4-5-8-13(12)18(23)26/h4-5,7-8,11H,2-3,6,9-10H2,1H3,(H,21,24)(H,27,28)