3-(4-chloranyl-2-methyl-5-propan-2-yl-phenoxy)propanenitrile

Systemtic Name: 3-(4-chloranyl-2-methyl-5-propan-2-yl-phenoxy)propanenitrile Openeye Name: 3-(4-chloro-5-isopropyl-2-methyl-phenoxy)propanenitrile CAS Name: 3-(4-chloro-2-methyl-5-propan-2-ylphenoxy)propanenitrile IUPAC Name: 3-(4-chloro-2-methyl-5-propan-2-ylphenoxy)propanenitrile Traditional Name: 3-(4-chloro-5-isopropyl-2-methyl-phenoxy)propionitrile Formula: C13H16ClNO MolecularWeight: 237.72524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)Cl)C(C)C)OCCC#N

Isomeric SMILES

CC1=C(C=C(C(=C1)Cl)C(C)C)OCCC#N

InChI

InChI=1S/C13H16ClNO/c1-9(2)11-8-13(16-6-4-5-15)10(3)7-12(11)14/h7-9H,4,6H2,1-3H3