3-[(3-ethoxy-2-oxidanyl-phenyl)methylamino]propanenitrile

Systemtic Name: 3-[(3-ethoxy-2-oxidanyl-phenyl)methylamino]propanenitrile Openeye Name: 3-[(3-ethoxy-2-hydroxy-phenyl)methylamino]propanenitrile CAS Name: 3-[(3-ethoxy-2-hydroxyphenyl)methylamino]propanenitrile IUPAC Name: 3-[(3-ethoxy-2-hydroxyphenyl)methylamino]propanenitrile Traditional Name: 3-[(3-ethoxy-2-hydroxy-benzyl)amino]propionitrile Formula: C12H16N2O2 MolecularWeight: 220.26764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)CNCCC#N

Isomeric SMILES

CCOC1=CC=CC(=C1O)CNCCC#N

InChI

InChI=1S/C12H16N2O2/c1-2-16-11-6-3-5-10(12(11)15)9-14-8-4-7-13/h3,5-6,14-15H,2,4,8-9H2,1H3