(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl quinoxaline-2-carboxylate

Systemtic Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl quinoxaline-2-carboxylate Openeye Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl quinoxaline-2-carboxylate CAS Name: 2-quinoxalinecarboxylic acid (4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methyl ester IUPAC Name: (4-cyano-5-methyl-2-phenylpyrazol-3-yl)methyl quinoxaline-2-carboxylate Traditional Name: quinoxaline-2-carboxylic acid (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl ester Formula: C21H15N5O2 MolecularWeight: 369.3761

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)COC(=O)C2=NC3=CC=CC=C3N=C2)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C#N)COC(=O)C2=NC3=CC=CC=C3N=C2)C4=CC=CC=C4

InChI

InChI=1S/C21H15N5O2/c1-14-16(11-22)20(26(25-14)15-7-3-2-4-8-15)13-28-21(27)19-12-23-17-9-5-6-10-18(17)24-19/h2-10,12H,13H2,1H3