[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 3,5-bis(chloranyl)-4-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 3,5-bis(chloranyl)-4-methoxy-benzoate Openeye Name: [2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 3,5-dichloro-4-methoxy-benzoate CAS Name: 3,5-dichloro-4-methoxybenzoic acid [2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl] 3,5-dichloro-4-methoxybenzoate Traditional Name: 3,5-dichloro-4-methoxy-benzoic acid [2-keto-2-(3-phenyl-2-pyrazolin-1-yl)ethyl] ester Formula: C19H16Cl2N2O4 MolecularWeight: 407.24734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C(=O)OCC(=O)N2CCC(=N2)C3=CC=CC=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C(=O)OCC(=O)N2CCC(=N2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C19H16Cl2N2O4/c1-26-18-14(20)9-13(10-15(18)21)19(25)27-11-17(24)23-8-7-16(22-23)12-5-3-2-4-6-12/h2-6,9-10H,7-8,11H2,1H3