N-[4-[(5-oxidanylidene-4-quinolin-2-yl-1,2-dihydropyrazol-3-yl)methyl]phenyl]ethanamide

Systemtic Name: N-[4-[(5-oxidanylidene-4-quinolin-2-yl-1,2-dihydropyrazol-3-yl)methyl]phenyl]ethanamide Openeye Name: N-[4-[[5-oxo-4-(2-quinolyl)-1,2-dihydropyrazol-3-yl]methyl]phenyl]acetamide CAS Name: N-[4-[[5-oxo-4-(2-quinolinyl)-1,2-dihydropyrazol-3-yl]methyl]phenyl]acetamide IUPAC Name: N-[4-[(5-oxo-4-quinolin-2-yl-1,2-dihydropyrazol-3-yl)methyl]phenyl]acetamide Traditional Name: N-[4-[[5-keto-4-(2-quinolyl)-3-pyrazolin-3-yl]methyl]phenyl]acetamide Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CC2=C(C(=O)NN2)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CC2=C(C(=O)NN2)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H18N4O2/c1-13(26)22-16-9-6-14(7-10-16)12-19-20(21(27)25-24-19)18-11-8-15-4-2-3-5-17(15)23-18/h2-11H,12H2,1H3,(H,22,26)(H2,24,25,27)