2-[(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]propanedinitrile; 3-methoxypropan-1-amine

Systemtic Name: 2-[(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]propanedinitrile; 3-methoxypropan-1-amine Openeye Name: 2-[(4-hydroxy-3-iodo-5-methoxy-phenyl)methylene]propanedinitrile; 3-methoxypropan-1-amine CAS Name: 2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]propanedinitrile; 3-methoxy-1-propanamine IUPAC Name: 2-[(4-hydroxy-3-iodo-5-methoxyphenyl)methylidene]propanedinitrile; 3-methoxypropan-1-amine Traditional Name: 2-(4-hydroxy-3-iodo-5-methoxy-benzylidene)malononitrile; 3-methoxypropylamine Formula: C15H18IN3O3 MolecularWeight: 415.22619

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCN.COC1=C(C(=CC(=C1)C=C(C#N)C#N)I)O

Isomeric SMILES

COCCCN.COC1=C(C(=CC(=C1)C=C(C#N)C#N)I)O

InChI

InChI=1S/C11H7IN2O2.C4H11NO/c1-16-10-4-7(2-8(5-13)6-14)3-9(12)11(10)15;1-6-4-2-3-5/h2-4,15H,1H3;2-5H2,1H3