propan-2-yl 4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]-1-ethyl-pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 4-[6-[1,3-bis(oxidanylidene)isoindol-2-yl]hexanoylamino]-1-ethyl-pyrazole-3-carboxylate Openeye Name: isopropyl 4-[6-(1,3-dioxoisoindolin-2-yl)hexanoylamino]-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-[[6-(1,3-dioxo-2-isoindolyl)-1-oxohexyl]amino]-1-ethyl-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[6-(1,3-dioxoisoindol-2-yl)hexanoylamino]-1-ethylpyrazole-3-carboxylate Traditional Name: 1-ethyl-4-(6-phthalimidohexanoylamino)pyrazole-3-carboxylic acid isopropyl ester Formula: C23H28N4O5 MolecularWeight: 440.49222

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C23H28N4O5/c1-4-26-14-18(20(25-26)23(31)32-15(2)3)24-19(28)12-6-5-9-13-27-21(29)16-10-7-8-11-17(16)22(27)30/h7-8,10-11,14-15H,4-6,9,12-13H2,1-3H3,(H,24,28)