4-(2-methoxy-3-methyl-phenyl)-5-methyl-hexanenitrile

Systemtic Name: 4-(2-methoxy-3-methyl-phenyl)-5-methyl-hexanenitrile Openeye Name: 4-(2-methoxy-3-methyl-phenyl)-5-methyl-hexanenitrile CAS Name: 4-(2-methoxy-3-methylphenyl)-5-methylhexanenitrile IUPAC Name: 4-(2-methoxy-3-methylphenyl)-5-methylhexanenitrile Traditional Name: 4-(2-methoxy-3-methyl-phenyl)-5-methyl-hexanenitrile Formula: C15H21NO MolecularWeight: 231.33334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(CCC#N)C(C)C)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C(CCC#N)C(C)C)OC

InChI

InChI=1S/C15H21NO/c1-11(2)13(9-6-10-16)14-8-5-7-12(3)15(14)17-4/h5,7-8,11,13H,6,9H2,1-4H3