3,5-bis(chloranyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-hexoxy-benzamide

Systemtic Name: 3,5-bis(chloranyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-hexoxy-benzamide Openeye Name: 3,5-dichloro-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-hexoxy-benzamide CAS Name: 3,5-dichloro-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-4-hexoxybenzamide IUPAC Name: 3,5-dichloro-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-hexoxybenzamide Traditional Name: 3,5-dichloro-4-hexoxy-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)benzamide Formula: C24H27Cl2N3O3 MolecularWeight: 476.39548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Cl)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)Cl

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Cl)C(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)Cl

InChI

InChI=1S/C24H27Cl2N3O3/c1-4-5-6-10-13-32-22-19(25)14-17(15-20(22)26)23(30)27-21-16(2)28(3)29(24(21)31)18-11-8-7-9-12-18/h7-9,11-12,14-15H,4-6,10,13H2,1-3H3,(H,27,30)