3-chloranyl-4-(8-oxidanylidene-7-propanoyl-decoxy)benzenecarbonitrile

Systemtic Name: 3-chloranyl-4-(8-oxidanylidene-7-propanoyl-decoxy)benzenecarbonitrile Openeye Name: 3-chloro-4-(8-oxo-7-propanoyl-decoxy)benzonitrile CAS Name: 3-chloro-4-[8-oxo-7-(1-oxopropyl)decoxy]benzonitrile IUPAC Name: 3-chloro-4-(8-oxo-7-propanoyldecoxy)benzonitrile Traditional Name: 3-chloro-4-(8-keto-7-propionyl-decoxy)benzonitrile Formula: C20H26ClNO3 MolecularWeight: 363.87834

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCCCOC1=C(C=C(C=C1)C#N)Cl)C(=O)CC

Isomeric SMILES

CCC(=O)C(CCCCCCOC1=C(C=C(C=C1)C#N)Cl)C(=O)CC

InChI

InChI=1S/C20H26ClNO3/c1-3-18(23)16(19(24)4-2)9-7-5-6-8-12-25-20-11-10-15(14-22)13-17(20)21/h10-11,13,16H,3-9,12H2,1-2H3