methyl 4-methyl-5-(4-methylphenyl)-3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyrazole-2-carboxylate

Systemtic Name: methyl 4-methyl-5-(4-methylphenyl)-3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyrazole-2-carboxylate Openeye Name: methyl 4-methyl-3-(4-oxocyclohexa-2,5-dien-1-ylidene)-5-(p-tolyl)-1H-pyrazole-2-carboxylate CAS Name: 4-methyl-5-(4-methylphenyl)-3-(4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyrazole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-methyl-5-(4-methylphenyl)-3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyrazole-2-carboxylate Traditional Name: 5-(4-ketocyclohexa-2,5-dien-1-ylidene)-4-methyl-3-(p-tolyl)-3-pyrazoline-1-carboxylic acid methyl ester Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C3C=CC(=O)C=C3)N(N2)C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C3C=CC(=O)C=C3)N(N2)C(=O)OC)C

InChI

InChI=1S/C19H18N2O3/c1-12-4-6-14(7-5-12)17-13(2)18(21(20-17)19(23)24-3)15-8-10-16(22)11-9-15/h4-11,20H,1-3H3