(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 4-methylbenzoate

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl 4-methylbenzoate Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C19H17ClN2O2 MolecularWeight: 340.80348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC2=C(N(N=C2C)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC2=C(N(N=C2C)C3=CC=CC=C3)Cl

InChI

InChI=1S/C19H17ClN2O2/c1-13-8-10-15(11-9-13)19(23)24-12-17-14(2)21-22(18(17)20)16-6-4-3-5-7-16/h3-11H,12H2,1-2H3