2-[1-(2-hydroxyphenyl)-3,5-dimethoxy-cyclohexa-2,5-dien-1-yl]ethanenitrile

Systemtic Name: 2-[1-(2-hydroxyphenyl)-3,5-dimethoxy-cyclohexa-2,5-dien-1-yl]ethanenitrile Openeye Name: 2-[1-(2-hydroxyphenyl)-3,5-dimethoxy-cyclohexa-2,5-dien-1-yl]acetonitrile CAS Name: 2-[1-(2-hydroxyphenyl)-3,5-dimethoxy-1-cyclohexa-2,5-dienyl]acetonitrile IUPAC Name: 2-[1-(2-hydroxyphenyl)-3,5-dimethoxycyclohexa-2,5-dien-1-yl]acetonitrile Traditional Name: 2-[1-(2-hydroxyphenyl)-3,5-dimethoxy-cyclohexa-2,5-dien-1-yl]acetonitrile Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(C=C(C1)OC)(CC#N)C2=CC=CC=C2O

Isomeric SMILES

COC1=CC(C=C(C1)OC)(CC#N)C2=CC=CC=C2O

InChI

InChI=1S/C16H17NO3/c1-19-12-9-13(20-2)11-16(10-12,7-8-17)14-5-3-4-6-15(14)18/h3-6,10-11,18H,7,9H2,1-2H3