3-[1-(2-methoxy-4-methyl-phenyl)ethylamino]propanenitrile

Systemtic Name: 3-[1-(2-methoxy-4-methyl-phenyl)ethylamino]propanenitrile Openeye Name: 3-[1-(2-methoxy-4-methyl-phenyl)ethylamino]propanenitrile CAS Name: 3-[1-(2-methoxy-4-methylphenyl)ethylamino]propanenitrile IUPAC Name: 3-[1-(2-methoxy-4-methylphenyl)ethylamino]propanenitrile Traditional Name: 3-[1-(2-methoxy-4-methyl-phenyl)ethylamino]propionitrile Formula: C13H18N2O MolecularWeight: 218.29482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O/c1-10-5-6-12(13(9-10)16-3)11(2)15-8-4-7-14/h5-6,9,11,15H,4,8H2,1-3H3