(5-phenyl-1,2-oxazol-3-yl)methyl 5-chloranyl-3-methyl-1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 5-chloranyl-3-methyl-1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: (5-phenylisoxazol-3-yl)methyl 1-benzyl-5-chloro-3-methyl-pyrazole-4-carboxylate CAS Name: 5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolecarboxylic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 1-benzyl-5-chloro-3-methylpyrazole-4-carboxylate Traditional Name: 1-benzyl-5-chloro-3-methyl-pyrazole-4-carboxylic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C22H18ClN3O3 MolecularWeight: 407.84962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OCC2=NOC(=C2)C3=CC=CC=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)OCC2=NOC(=C2)C3=CC=CC=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C22H18ClN3O3/c1-15-20(21(23)26(24-15)13-16-8-4-2-5-9-16)22(27)28-14-18-12-19(29-25-18)17-10-6-3-7-11-17/h2-12H,13-14H2,1H3