4-chloranyl-6-[5-(2-methylphenyl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-6-[5-(2-methylphenyl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-6-[5-(o-tolyl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-6-[5-(2-methylphenyl)-1,2-dihydropyrazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-6-[5-(2-methylphenyl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-6-[5-(o-tolyl)-3-pyrazolin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C16H13ClN2O MolecularWeight: 284.74022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=C3C=C(C=CC3=O)Cl)NN2

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=C3C=C(C=CC3=O)Cl)NN2

InChI

InChI=1S/C16H13ClN2O/c1-10-4-2-3-5-12(10)14-9-15(19-18-14)13-8-11(17)6-7-16(13)20/h2-9,18-19H,1H3