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

Systemtic Name: 5-[3-(3,4-dimethylphenyl)-3-oxidanylidene-propanoyl]-2,3-dimethyl-6-oxidanyl-benzenecarbonitrile Openeye Name: 3-[3-(3,4-dimethylphenyl)-3-oxo-propanoyl]-2-hydroxy-5,6-dimethyl-benzonitrile CAS Name: 3-[3-(3,4-dimethylphenyl)-1,3-dioxopropyl]-2-hydroxy-5,6-dimethylbenzonitrile IUPAC Name: 3-[3-(3,4-dimethylphenyl)-3-oxopropanoyl]-2-hydroxy-5,6-dimethylbenzonitrile Traditional Name: 3-[3-(3,4-dimethylphenyl)-3-keto-propanoyl]-2-hydroxy-5,6-dimethyl-benzonitrile Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CC(=O)C2=CC(=C(C(=C2O)C#N)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CC(=O)C2=CC(=C(C(=C2O)C#N)C)C)C

InChI

InChI=1S/C20H19NO3/c1-11-5-6-15(7-12(11)2)18(22)9-19(23)16-8-13(3)14(4)17(10-21)20(16)24/h5-8,24H,9H2,1-4H3