[2-(diethylamino)-2-oxidanylidene-ethyl] 4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)benzoate

Systemtic Name: [2-(diethylamino)-2-oxidanylidene-ethyl] 4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)benzoate Openeye Name: [2-(diethylamino)-2-oxo-ethyl] 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)benzoate CAS Name: 4-(4-chloro-3,5-dimethyl-1-pyrazolyl)benzoic acid [2-(diethylamino)-2-oxoethyl] ester IUPAC Name: [2-(diethylamino)-2-oxoethyl] 4-(4-chloro-3,5-dimethylpyrazol-1-yl)benzoate Traditional Name: 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)benzoic acid [2-(diethylamino)-2-keto-ethyl] ester Formula: C18H22ClN3O3 MolecularWeight: 363.83858

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC(=O)C1=CC=C(C=C1)N2C(=C(C(=N2)C)Cl)C

Isomeric SMILES

CCN(CC)C(=O)COC(=O)C1=CC=C(C=C1)N2C(=C(C(=N2)C)Cl)C

InChI

InChI=1S/C18H22ClN3O3/c1-5-21(6-2)16(23)11-25-18(24)14-7-9-15(10-8-14)22-13(4)17(19)12(3)20-22/h7-10H,5-6,11H2,1-4H3