(3-methylphenyl)methyl 3-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]benzoate

Systemtic Name: (3-methylphenyl)methyl 3-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]benzoate Openeye Name: m-tolylmethyl 3-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]benzoate CAS Name: 3-[(4-chloro-3,5-dimethyl-1-pyrazolyl)methyl]benzoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 3-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]benzoate Traditional Name: 3-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]benzoic acid (3-methylbenzyl) ester Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2=CC(=CC=C2)CN3C(=C(C(=N3)C)Cl)C

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2=CC(=CC=C2)CN3C(=C(C(=N3)C)Cl)C

InChI

InChI=1S/C21H21ClN2O2/c1-14-6-4-8-18(10-14)13-26-21(25)19-9-5-7-17(11-19)12-24-16(3)20(22)15(2)23-24/h4-11H,12-13H2,1-3H3