2-[4-[(3-methoxy-4-oxidanyl-phenyl)methylamino]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(3-methoxy-4-oxidanyl-phenyl)methylamino]phenoxy]ethanenitrile Openeye Name: 2-[4-[(4-hydroxy-3-methoxy-phenyl)methylamino]phenoxy]acetonitrile CAS Name: 2-[4-[(4-hydroxy-3-methoxyphenyl)methylamino]phenoxy]acetonitrile IUPAC Name: 2-[4-[(4-hydroxy-3-methoxyphenyl)methylamino]phenoxy]acetonitrile Traditional Name: 2-[4-(vanillylamino)phenoxy]acetonitrile Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=CC=C(C=C2)OCC#N)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=CC=C(C=C2)OCC#N)O

InChI

InChI=1S/C16H16N2O3/c1-20-16-10-12(2-7-15(16)19)11-18-13-3-5-14(6-4-13)21-9-8-17/h2-7,10,18-19H,9,11H2,1H3