3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl]-N-phenethyl-4,5-dihydro-1H-pyrazole-5-carboxamide

Systemtic Name: 3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl]-N-phenethyl-4,5-dihydro-1H-pyrazole-5-carboxamide Openeye Name: 3-[2-(1,3-dioxoisoindolin-2-yl)acetyl]-N-phenethyl-4,5-dihydro-1H-pyrazole-5-carboxamide CAS Name: 3-[2-(1,3-dioxo-2-isoindolyl)-1-oxoethyl]-N-phenethyl-4,5-dihydro-1H-pyrazole-5-carboxamide IUPAC Name: 3-[2-(1,3-dioxoisoindol-2-yl)acetyl]-N-phenethyl-4,5-dihydro-1H-pyrazole-5-carboxamide Traditional Name: N-phenethyl-5-(2-phthalimidoacetyl)-2-pyrazoline-3-carboxamide Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NN=C1C(=O)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1C(NN=C1C(=O)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C22H20N4O4/c27-19(13-26-21(29)15-8-4-5-9-16(15)22(26)30)17-12-18(25-24-17)20(28)23-11-10-14-6-2-1-3-7-14/h1-9,18,25H,10-13H2,(H,23,28)