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

Systemtic Name: 2-[(3-methoxy-4-phenethyloxy-phenyl)methylamino]ethanenitrile Openeye Name: 2-[(3-methoxy-4-phenethyloxy-phenyl)methylamino]acetonitrile CAS Name: 2-[(3-methoxy-4-phenethyloxyphenyl)methylamino]acetonitrile IUPAC Name: 2-[(3-methoxy-4-phenethyloxyphenyl)methylamino]acetonitrile Traditional Name: 2-[(3-methoxy-4-phenethyloxy-benzyl)amino]acetonitrile Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNCC#N)OCCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)CNCC#N)OCCC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O2/c1-21-18-13-16(14-20-11-10-19)7-8-17(18)22-12-9-15-5-3-2-4-6-15/h2-8,13,20H,9,11-12,14H2,1H3