5-[3-(3,4-dichlorophenyl)-3-oxidanylidene-propanoyl]-2,3-dimethyl-6-oxidanyl-benzenecarbonitrile

Systemtic Name: 5-[3-(3,4-dichlorophenyl)-3-oxidanylidene-propanoyl]-2,3-dimethyl-6-oxidanyl-benzenecarbonitrile Openeye Name: 3-[3-(3,4-dichlorophenyl)-3-oxo-propanoyl]-2-hydroxy-5,6-dimethyl-benzonitrile CAS Name: 3-[3-(3,4-dichlorophenyl)-1,3-dioxopropyl]-2-hydroxy-5,6-dimethylbenzonitrile IUPAC Name: 3-[3-(3,4-dichlorophenyl)-3-oxopropanoyl]-2-hydroxy-5,6-dimethylbenzonitrile Traditional Name: 3-[3-(3,4-dichlorophenyl)-3-keto-propanoyl]-2-hydroxy-5,6-dimethyl-benzonitrile Formula: C18H13Cl2NO3 MolecularWeight: 362.20672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=O)CC(=O)C2=CC(=C(C=C2)Cl)Cl)O)C#N)C

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=O)CC(=O)C2=CC(=C(C=C2)Cl)Cl)O)C#N)C

InChI

InChI=1S/C18H13Cl2NO3/c1-9-5-12(18(24)13(8-21)10(9)2)17(23)7-16(22)11-3-4-14(19)15(20)6-11/h3-6,24H,7H2,1-2H3