2-[[(4-butoxy-3-methoxy-phenyl)methylamino]methylidene]propanedinitrile

Systemtic Name: 2-[[(4-butoxy-3-methoxy-phenyl)methylamino]methylidene]propanedinitrile Openeye Name: 2-[[(4-butoxy-3-methoxy-phenyl)methylamino]methylene]propanedinitrile CAS Name: 2-[[(4-butoxy-3-methoxyphenyl)methylamino]methylidene]propanedinitrile IUPAC Name: 2-[[(4-butoxy-3-methoxyphenyl)methylamino]methylidene]propanedinitrile Traditional Name: 2-[[(4-butoxy-3-methoxy-benzyl)amino]methylene]malononitrile Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC=C(C#N)C#N)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC=C(C#N)C#N)OC

InChI

InChI=1S/C16H19N3O2/c1-3-4-7-21-15-6-5-13(8-16(15)20-2)11-19-12-14(9-17)10-18/h5-6,8,12,19H,3-4,7,11H2,1-2H3