[2-[[3,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-1-phenyl-ethyl] 1H-pyrazole-5-carboxylate

Systemtic Name: [2-[[3,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-1-phenyl-ethyl] 1H-pyrazole-5-carboxylate Openeye Name: [2-(3,5-dichloroanilino)-2-oxo-1-phenyl-ethyl] 1H-pyrazole-5-carboxylate CAS Name: 1H-pyrazole-5-carboxylic acid [2-(3,5-dichloroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(3,5-dichloroanilino)-2-oxo-1-phenylethyl] 1H-pyrazole-5-carboxylate Traditional Name: 1H-pyrazole-5-carboxylic acid [2-(3,5-dichloroanilino)-2-keto-1-phenyl-ethyl] ester Formula: C18H13Cl2N3O3 MolecularWeight: 390.22012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC(=CC(=C2)Cl)Cl)OC(=O)C3=CC=NN3

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC(=CC(=C2)Cl)Cl)OC(=O)C3=CC=NN3

InChI

InChI=1S/C18H13Cl2N3O3/c19-12-8-13(20)10-14(9-12)22-17(24)16(11-4-2-1-3-5-11)26-18(25)15-6-7-21-23-15/h1-10,16H,(H,21,23)(H,22,24)