3-[2-(4-butoxyphenyl)ethyl-phenyl-amino]propanenitrile

Systemtic Name: 3-[2-(4-butoxyphenyl)ethyl-phenyl-amino]propanenitrile Openeye Name: 3-[N-[2-(4-butoxyphenyl)ethyl]anilino]propanenitrile CAS Name: 3-[N-[2-(4-butoxyphenyl)ethyl]anilino]propanenitrile IUPAC Name: 3-[N-[2-(4-butoxyphenyl)ethyl]anilino]propanenitrile Traditional Name: 3-[N-[2-(4-butoxyphenyl)ethyl]anilino]propionitrile Formula: C21H26N2O MolecularWeight: 322.44394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CCN(CCC#N)C2=CC=CC=C2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CCN(CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C21H26N2O/c1-2-3-18-24-21-12-10-19(11-13-21)14-17-23(16-7-15-22)20-8-5-4-6-9-20/h4-6,8-13H,2-3,7,14,16-18H2,1H3