4-[3-(2,5-dimethylfuran-3-yl)-3-oxidanylidene-propanoyl]benzenecarbonitrile

Systemtic Name: 4-[3-(2,5-dimethylfuran-3-yl)-3-oxidanylidene-propanoyl]benzenecarbonitrile Openeye Name: 4-[3-(2,5-dimethyl-3-furyl)-3-oxo-propanoyl]benzonitrile CAS Name: 4-[3-(2,5-dimethyl-3-furanyl)-1,3-dioxopropyl]benzonitrile IUPAC Name: 4-[3-(2,5-dimethylfuran-3-yl)-3-oxopropanoyl]benzonitrile Traditional Name: 4-[3-(2,5-dimethyl-3-furyl)-3-keto-propanoyl]benzonitrile Formula: C16H13NO3 MolecularWeight: 267.27932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)CC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)CC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H13NO3/c1-10-7-14(11(2)20-10)16(19)8-15(18)13-5-3-12(9-17)4-6-13/h3-7H,8H2,1-2H3