(4E)-2-(3-chloranyl-4-methyl-phenyl)-5-methyl-4-(phenylmethylidene)pyrazol-3-one

Systemtic Name: (4E)-2-(3-chloranyl-4-methyl-phenyl)-5-methyl-4-(phenylmethylidene)pyrazol-3-one Openeye Name: (4E)-4-benzylidene-2-(3-chloro-4-methyl-phenyl)-5-methyl-pyrazol-3-one CAS Name: (4E)-2-(3-chloro-4-methylphenyl)-5-methyl-4-(phenylmethylene)-3-pyrazolone IUPAC Name: (4E)-4-benzylidene-2-(3-chloro-4-methylphenyl)-5-methylpyrazol-3-one Traditional Name: (4E)-4-benzal-2-(3-chloro-4-methyl-phenyl)-5-methyl-2-pyrazolin-3-one Formula: C18H15ClN2O MolecularWeight: 310.7775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=CC=C3)C(=N2)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)/C(=C/C3=CC=CC=C3)/C(=N2)C)Cl

InChI

InChI=1S/C18H15ClN2O/c1-12-8-9-15(11-17(12)19)21-18(22)16(13(2)20-21)10-14-6-4-3-5-7-14/h3-11H,1-2H3/b16-10+