3-[2,4-bis(oxidanylidene)pentan-3-yloxy]-5-chloranyl-benzenecarbonitrile

Systemtic Name: 3-[2,4-bis(oxidanylidene)pentan-3-yloxy]-5-chloranyl-benzenecarbonitrile Openeye Name: 3-(1-acetyl-2-oxo-propoxy)-5-chloro-benzonitrile CAS Name: 3-chloro-5-(2,4-dioxopentan-3-yloxy)benzonitrile IUPAC Name: 3-chloro-5-(2,4-dioxopentan-3-yloxy)benzonitrile Traditional Name: 3-(1-acetyl-2-keto-propoxy)-5-chloro-benzonitrile Formula: C12H10ClNO3 MolecularWeight: 251.6657

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C)OC1=CC(=CC(=C1)C#N)Cl

Isomeric SMILES

CC(=O)C(C(=O)C)OC1=CC(=CC(=C1)C#N)Cl

InChI

InChI=1S/C12H10ClNO3/c1-7(15)12(8(2)16)17-11-4-9(6-14)3-10(13)5-11/h3-5,12H,1-2H3