[4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl quinoxaline-2-carboxylate

Systemtic Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl quinoxaline-2-carboxylate Openeye Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl quinoxaline-2-carboxylate CAS Name: 2-quinoxalinecarboxylic acid [4-(3,5-dimethyl-1-pyrazolyl)phenyl]methyl ester IUPAC Name: [4-(3,5-dimethylpyrazol-1-yl)phenyl]methyl quinoxaline-2-carboxylate Traditional Name: quinoxaline-2-carboxylic acid [4-(3,5-dimethylpyrazol-1-yl)benzyl] ester Formula: C21H18N4O2 MolecularWeight: 358.39322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)COC(=O)C3=NC4=CC=CC=C4N=C3)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)COC(=O)C3=NC4=CC=CC=C4N=C3)C

InChI

InChI=1S/C21H18N4O2/c1-14-11-15(2)25(24-14)17-9-7-16(8-10-17)13-27-21(26)20-12-22-18-5-3-4-6-19(18)23-20/h3-12H,13H2,1-2H3