4-(5-methoxy-3-oxidanylidene-pentanoyl)benzenecarbonitrile

Systemtic Name: 4-(5-methoxy-3-oxidanylidene-pentanoyl)benzenecarbonitrile Openeye Name: 4-(5-methoxy-3-oxo-pentanoyl)benzonitrile CAS Name: 4-(5-methoxy-1,3-dioxopentyl)benzonitrile IUPAC Name: 4-(5-methoxy-3-oxopentanoyl)benzonitrile Traditional Name: 4-(3-keto-5-methoxy-pentanoyl)benzonitrile Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(=O)CC(=O)C1=CC=C(C=C1)C#N

Isomeric SMILES

COCCC(=O)CC(=O)C1=CC=C(C=C1)C#N

InChI

InChI=1S/C13H13NO3/c1-17-7-6-12(15)8-13(16)11-4-2-10(9-14)3-5-11/h2-5H,6-8H2,1H3