2-chloranyl-4-(5-oxidanylhexan-2-yloxy)benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-(5-oxidanylhexan-2-yloxy)benzenecarbonitrile Openeye Name: 2-chloro-4-(4-hydroxy-1-methyl-pentoxy)benzonitrile CAS Name: 2-chloro-4-(5-hydroxyhexan-2-yloxy)benzonitrile IUPAC Name: 2-chloro-4-(5-hydroxyhexan-2-yloxy)benzonitrile Traditional Name: 2-chloro-4-(4-hydroxy-1-methyl-pentoxy)benzonitrile Formula: C13H16ClNO2 MolecularWeight: 253.72464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClNO2/c1-9(16)3-4-10(2)17-12-6-5-11(8-15)13(14)7-12/h5-7,9-10,16H,3-4H2,1-2H3