(6Z)-6-(3-butyl-4-pentanoyl-2-phenyl-1H-pyrazol-5-ylidene)-2,4-bis(chloranyl)cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-(3-butyl-4-pentanoyl-2-phenyl-1H-pyrazol-5-ylidene)-2,4-bis(chloranyl)cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-(3-butyl-4-pentanoyl-2-phenyl-1H-pyrazol-5-ylidene)-2,4-dichloro-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[3-butyl-4-(1-oxopentyl)-2-phenyl-1H-pyrazol-5-ylidene]-2,4-dichloro-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-(3-butyl-4-pentanoyl-2-phenyl-1H-pyrazol-5-ylidene)-2,4-dichlorocyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-(5-butyl-1-phenyl-4-valeryl-3-pyrazolin-3-ylidene)-2,4-dichloro-cyclohexa-2,4-dien-1-one Formula: C24H26Cl2N2O2 MolecularWeight: 445.38144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C2C=C(C=C(C2=O)Cl)Cl)NN1C3=CC=CC=C3)C(=O)CCCC

Isomeric SMILES

CCCCC1=C(/C(=C/2\C=C(C=C(C2=O)Cl)Cl)/NN1C3=CC=CC=C3)C(=O)CCCC

InChI

InChI=1S/C24H26Cl2N2O2/c1-3-5-12-20-22(21(29)13-6-4-2)23(18-14-16(25)15-19(26)24(18)30)27-28(20)17-10-8-7-9-11-17/h7-11,14-15,27H,3-6,12-13H2,1-2H3/b23-18-