(4-chloranyl-3-methyl-phenyl) (5E)-5-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxylate

Systemtic Name: (4-chloranyl-3-methyl-phenyl) (5E)-5-(5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxylate Openeye Name: (4-chloro-3-methyl-phenyl) (5E)-5-(5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxylate CAS Name: (5E)-5-(5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-1,2-dihydropyrazole-3-carboxylic acid (4-chloro-3-methylphenyl) ester IUPAC Name: (4-chloro-3-methylphenyl) (5E)-5-(5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydropyrazole-3-carboxylate Traditional Name: (5E)-5-(6-keto-5-methyl-cyclohexa-2,4-dien-1-ylidene)-3-pyrazoline-3-carboxylic acid (4-chloro-3-methyl-phenyl) ester Formula: C18H15ClN2O3 MolecularWeight: 342.7763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C2C=C(NN2)C(=O)OC3=CC(=C(C=C3)Cl)C)C1=O

Isomeric SMILES

CC1=CC=C/C(=C\2/C=C(NN2)C(=O)OC3=CC(=C(C=C3)Cl)C)/C1=O

InChI

InChI=1S/C18H15ClN2O3/c1-10-4-3-5-13(17(10)22)15-9-16(21-20-15)18(23)24-12-6-7-14(19)11(2)8-12/h3-9,20-21H,1-2H3/b15-13+