(4-chloranyl-2-methyl-phenyl) 4-[4-(3-methoxy-3-oxidanylidene-propyl)-3,5-dimethyl-pyrazol-1-yl]benzoate

Systemtic Name: (4-chloranyl-2-methyl-phenyl) 4-[4-(3-methoxy-3-oxidanylidene-propyl)-3,5-dimethyl-pyrazol-1-yl]benzoate Openeye Name: (4-chloro-2-methyl-phenyl) 4-[4-(3-methoxy-3-oxo-propyl)-3,5-dimethyl-pyrazol-1-yl]benzoate CAS Name: 4-[4-(3-methoxy-3-oxopropyl)-3,5-dimethyl-1-pyrazolyl]benzoic acid (4-chloro-2-methylphenyl) ester IUPAC Name: (4-chloro-2-methylphenyl) 4-[4-(3-methoxy-3-oxopropyl)-3,5-dimethylpyrazol-1-yl]benzoate Traditional Name: 4-[4-(3-keto-3-methoxy-propyl)-3,5-dimethyl-pyrazol-1-yl]benzoic acid (4-chloro-2-methyl-phenyl) ester Formula: C23H23ClN2O4 MolecularWeight: 426.89272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(=O)C2=CC=C(C=C2)N3C(=C(C(=N3)C)CCC(=O)OC)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC(=O)C2=CC=C(C=C2)N3C(=C(C(=N3)C)CCC(=O)OC)C

InChI

InChI=1S/C23H23ClN2O4/c1-14-13-18(24)7-11-21(14)30-23(28)17-5-8-19(9-6-17)26-16(3)20(15(2)25-26)10-12-22(27)29-4/h5-9,11,13H,10,12H2,1-4H3