2,3-bis(chloranyl)-4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)imino-but-2-enoic acid

Systemtic Name: 2,3-bis(chloranyl)-4-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)imino-but-2-enoic acid Openeye Name: 2,3-dichloro-4-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)imino-but-2-enoic acid CAS Name: 2,3-dichloro-4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)imino]-2-butenoic acid IUPAC Name: 2,3-dichloro-4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)iminobut-2-enoic acid Traditional Name: 2,3-dichloro-4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)imino]but-2-enoic acid Formula: C15H13Cl2N3O3 MolecularWeight: 354.18802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC(=C(C(=O)O)Cl)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC(=C(C(=O)O)Cl)Cl

InChI

InChI=1S/C15H13Cl2N3O3/c1-9-13(18-8-11(16)12(17)15(22)23)14(21)20(19(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,22,23)