4-[3-[5-chloranyl-1-(3-chlorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoyl]benzenecarbonitrile

Systemtic Name: 4-[3-[5-chloranyl-1-(3-chlorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoyl]benzenecarbonitrile Openeye Name: 4-[3-[5-chloro-1-(3-chlorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoyl]benzonitrile CAS Name: 4-[3-[5-chloro-1-(3-chlorophenyl)-3-methyl-4-pyrazolyl]-1-oxoprop-2-enyl]benzonitrile IUPAC Name: 4-[3-[5-chloro-1-(3-chlorophenyl)-3-methylpyrazol-4-yl]prop-2-enoyl]benzonitrile Traditional Name: 4-[3-[5-chloro-1-(3-chlorophenyl)-3-methyl-pyrazol-4-yl]acryloyl]benzonitrile Formula: C20H13Cl2N3O MolecularWeight: 382.24272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13Cl2N3O/c1-13-18(9-10-19(26)15-7-5-14(12-23)6-8-15)20(22)25(24-13)17-4-2-3-16(21)11-17/h2-11H,1H3