(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 3-(methoxymethyl)benzoate

Systemtic Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 3-(methoxymethyl)benzoate Openeye Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 3-(methoxymethyl)benzoate CAS Name: 3-(methoxymethyl)benzoic acid (4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methyl ester IUPAC Name: (4-cyano-5-methyl-2-phenylpyrazol-3-yl)methyl 3-(methoxymethyl)benzoate Traditional Name: 3-(methoxymethyl)benzoic acid (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)COC(=O)C2=CC(=CC=C2)COC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C#N)COC(=O)C2=CC(=CC=C2)COC)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O3/c1-15-19(12-22)20(24(23-15)18-9-4-3-5-10-18)14-27-21(25)17-8-6-7-16(11-17)13-26-2/h3-11H,13-14H2,1-2H3