2-chloranyl-4-(2,2,4-trimethyl-3-oxidanyl-pentoxy)benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-(2,2,4-trimethyl-3-oxidanyl-pentoxy)benzenecarbonitrile Openeye Name: 2-chloro-4-(3-hydroxy-2,2,4-trimethyl-pentoxy)benzonitrile CAS Name: 2-chloro-4-(3-hydroxy-2,2,4-trimethylpentoxy)benzonitrile IUPAC Name: 2-chloro-4-(3-hydroxy-2,2,4-trimethylpentoxy)benzonitrile Traditional Name: 2-chloro-4-(3-hydroxy-2,2,4-trimethyl-pentoxy)benzonitrile Formula: C15H20ClNO2 MolecularWeight: 281.7778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)(C)COC1=CC(=C(C=C1)C#N)Cl)O

Isomeric SMILES

CC(C)C(C(C)(C)COC1=CC(=C(C=C1)C#N)Cl)O

InChI

InChI=1S/C15H20ClNO2/c1-10(2)14(18)15(3,4)9-19-12-6-5-11(8-17)13(16)7-12/h5-7,10,14,18H,9H2,1-4H3