4-chloranyl-N-[(E)-2-cyano-3-(2,4-dichlorophenyl)prop-2-enoyl]-3,5-dimethyl-pyrazole-1-carboxamide

Systemtic Name: 4-chloranyl-N-[(E)-2-cyano-3-(2,4-dichlorophenyl)prop-2-enoyl]-3,5-dimethyl-pyrazole-1-carboxamide Openeye Name: 4-chloro-N-[(E)-2-cyano-3-(2,4-dichlorophenyl)prop-2-enoyl]-3,5-dimethyl-pyrazole-1-carboxamide CAS Name: 4-chloro-N-[(E)-2-cyano-3-(2,4-dichlorophenyl)-1-oxoprop-2-enyl]-3,5-dimethyl-1-pyrazolecarboxamide IUPAC Name: 4-chloro-N-[(E)-2-cyano-3-(2,4-dichlorophenyl)prop-2-enoyl]-3,5-dimethylpyrazole-1-carboxamide Traditional Name: 4-chloro-N-[(E)-2-cyano-3-(2,4-dichlorophenyl)acryloyl]-3,5-dimethyl-pyrazole-1-carboxamide Formula: C16H11Cl3N4O2 MolecularWeight: 397.64314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)NC(=O)C(=CC2=C(C=C(C=C2)Cl)Cl)C#N)C)Cl

Isomeric SMILES

CC1=C(C(=NN1C(=O)NC(=O)/C(=C/C2=C(C=C(C=C2)Cl)Cl)/C#N)C)Cl

InChI

InChI=1S/C16H11Cl3N4O2/c1-8-14(19)9(2)23(22-8)16(25)21-15(24)11(7-20)5-10-3-4-12(17)6-13(10)18/h3-6H,1-2H3,(H,21,24,25)/b11-5+