3-[3-(3-chlorophenyl)-4-[(Z)-3-(4-chlorophenyl)-3-oxidanylidene-prop-1-enyl]pyrazol-1-yl]propanoate

Systemtic Name: 3-[3-(3-chlorophenyl)-4-[(Z)-3-(4-chlorophenyl)-3-oxidanylidene-prop-1-enyl]pyrazol-1-yl]propanoate Openeye Name: 3-[3-(3-chlorophenyl)-4-[(Z)-3-(4-chlorophenyl)-3-oxo-prop-1-enyl]pyrazol-1-yl]propanoate CAS Name: 3-[3-(3-chlorophenyl)-4-[(Z)-3-(4-chlorophenyl)-3-oxoprop-1-enyl]-1-pyrazolyl]propanoate IUPAC Name: 3-[3-(3-chlorophenyl)-4-[(Z)-3-(4-chlorophenyl)-3-oxoprop-1-enyl]pyrazol-1-yl]propanoate Traditional Name: 3-[3-(3-chlorophenyl)-4-[(Z)-3-(4-chlorophenyl)-3-keto-prop-1-enyl]pyrazol-1-yl]propionate Formula: C21H15Cl2N2O3- MolecularWeight: 414.2614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=NN(C=C2C=CC(=O)C3=CC=C(C=C3)Cl)CCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=NN(C=C2/C=C\C(=O)C3=CC=C(C=C3)Cl)CCC(=O)[O-]

InChI

InChI=1S/C21H16Cl2N2O3/c22-17-7-4-14(5-8-17)19(26)9-6-16-13-25(11-10-20(27)28)24-21(16)15-2-1-3-18(23)12-15/h1-9,12-13H,10-11H2,(H,27,28)/p-1/b9-6-