(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-[(2,4-dichlorophenyl)carbonylamino]ethanoate

Systemtic Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-[(2,4-dichlorophenyl)carbonylamino]ethanoate Openeye Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate CAS Name: 2-[[(2,4-dichlorophenyl)-oxomethyl]amino]acetic acid (4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methyl ester IUPAC Name: (4-cyano-5-methyl-2-phenylpyrazol-3-yl)methyl 2-[(2,4-dichlorobenzoyl)amino]acetate Traditional Name: 2-[(2,4-dichlorobenzoyl)amino]acetic acid (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl ester Formula: C21H16Cl2N4O3 MolecularWeight: 443.28274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)COC(=O)CNC(=O)C2=C(C=C(C=C2)Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C#N)COC(=O)CNC(=O)C2=C(C=C(C=C2)Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H16Cl2N4O3/c1-13-17(10-24)19(27(26-13)15-5-3-2-4-6-15)12-30-20(28)11-25-21(29)16-8-7-14(22)9-18(16)23/h2-9H,11-12H2,1H3,(H,25,29)