(2Z)-3-[3,5-bis(chloranyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-2-(5-methyl-1,2-dihydropyrazol-3-ylidene)propanoic acid

Systemtic Name: (2Z)-3-[3,5-bis(chloranyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]-2-(5-methyl-1,2-dihydropyrazol-3-ylidene)propanoic acid Openeye Name: (2Z)-3-(3,5-dichloro-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,2-dihydropyrazol-3-ylidene)propanoic acid CAS Name: (2Z)-3-(3,5-dichloro-4-oxo-1-cyclohexa-2,5-dienylidene)-2-(5-methyl-1,2-dihydropyrazol-3-ylidene)propanoic acid IUPAC Name: (2Z)-3-(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,2-dihydropyrazol-3-ylidene)propanoic acid Traditional Name: (2Z)-3-(3,5-dichloro-4-keto-cyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-3-pyrazolin-3-ylidene)propionic acid Formula: C13H10Cl2N2O3 MolecularWeight: 313.1361

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C2C=C(C(=O)C(=C2)Cl)Cl)C(=O)O)NN1

Isomeric SMILES

CC1=C/C(=C(\C=C2C=C(C(=O)C(=C2)Cl)Cl)/C(=O)O)/NN1

InChI

InChI=1S/C13H10Cl2N2O3/c1-6-2-11(17-16-6)8(13(19)20)3-7-4-9(14)12(18)10(15)5-7/h2-5,16-17H,1H3,(H,19,20)/b11-8-