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

Systemtic Name: 5-[3-(2-methoxyphenyl)-3-oxidanylidene-propanoyl]-2,3-dimethyl-6-oxidanyl-benzenecarbonitrile Openeye Name: 2-hydroxy-3-[3-(2-methoxyphenyl)-3-oxo-propanoyl]-5,6-dimethyl-benzonitrile CAS Name: 2-hydroxy-3-[3-(2-methoxyphenyl)-1,3-dioxopropyl]-5,6-dimethylbenzonitrile IUPAC Name: 2-hydroxy-3-[3-(2-methoxyphenyl)-3-oxopropanoyl]-5,6-dimethylbenzonitrile Traditional Name: 2-hydroxy-3-[3-keto-3-(2-methoxyphenyl)propanoyl]-5,6-dimethyl-benzonitrile Formula: C19H17NO4 MolecularWeight: 323.34258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=O)CC(=O)C2=CC=CC=C2OC)O)C#N)C

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=O)CC(=O)C2=CC=CC=C2OC)O)C#N)C

InChI

InChI=1S/C19H17NO4/c1-11-8-14(19(23)15(10-20)12(11)2)17(22)9-16(21)13-6-4-5-7-18(13)24-3/h4-8,23H,9H2,1-3H3