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

Systemtic Name: 2-[3-[(3-methoxy-4-oxidanyl-phenyl)methylamino]phenoxy]ethanenitrile Openeye Name: 2-[3-[(4-hydroxy-3-methoxy-phenyl)methylamino]phenoxy]acetonitrile CAS Name: 2-[3-[(4-hydroxy-3-methoxyphenyl)methylamino]phenoxy]acetonitrile IUPAC Name: 2-[3-[(4-hydroxy-3-methoxyphenyl)methylamino]phenoxy]acetonitrile Traditional Name: 2-[3-(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(=CC=C2)OCC#N)O

Isomeric SMILES

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

InChI

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