3-(4-chloranyl-2-methyl-phenoxy)pentanenitrile

Systemtic Name: 3-(4-chloranyl-2-methyl-phenoxy)pentanenitrile Openeye Name: 3-(4-chloro-2-methyl-phenoxy)pentanenitrile CAS Name: 3-(4-chloro-2-methylphenoxy)pentanenitrile IUPAC Name: 3-(4-chloro-2-methylphenoxy)pentanenitrile Traditional Name: 3-(4-chloro-2-methyl-phenoxy)valeronitrile Formula: C12H14ClNO MolecularWeight: 223.69866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClNO/c1-3-11(6-7-14)15-12-5-4-10(13)8-9(12)2/h4-5,8,11H,3,6H2,1-2H3