5-chloranyl-2-[(3-chloranyl-4-methyl-phenyl)methyl]-4-(phenylmethyl)-1H-pyrazol-3-one

Systemtic Name: 5-chloranyl-2-[(3-chloranyl-4-methyl-phenyl)methyl]-4-(phenylmethyl)-1H-pyrazol-3-one Openeye Name: 4-benzyl-5-chloro-2-[(3-chloro-4-methyl-phenyl)methyl]-1H-pyrazol-3-one CAS Name: 5-chloro-2-[(3-chloro-4-methylphenyl)methyl]-4-(phenylmethyl)-1H-pyrazol-3-one IUPAC Name: 4-benzyl-5-chloro-2-[(3-chloro-4-methylphenyl)methyl]-1H-pyrazol-3-one Traditional Name: 4-benzyl-5-chloro-2-(3-chloro-4-methyl-benzyl)-3-pyrazolin-3-one Formula: C18H16Cl2N2O MolecularWeight: 347.23844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN2C(=O)C(=C(N2)Cl)CC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CN2C(=O)C(=C(N2)Cl)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C18H16Cl2N2O/c1-12-7-8-14(10-16(12)19)11-22-18(23)15(17(20)21-22)9-13-5-3-2-4-6-13/h2-8,10,21H,9,11H2,1H3