2-[3,5-dimethoxy-1-(3-methoxy-4-oxidanyl-phenyl)cyclohexa-2,5-dien-1-yl]ethanenitrile

Systemtic Name: 2-[3,5-dimethoxy-1-(3-methoxy-4-oxidanyl-phenyl)cyclohexa-2,5-dien-1-yl]ethanenitrile Openeye Name: 2-[1-(4-hydroxy-3-methoxy-phenyl)-3,5-dimethoxy-cyclohexa-2,5-dien-1-yl]acetonitrile CAS Name: 2-[1-(4-hydroxy-3-methoxyphenyl)-3,5-dimethoxy-1-cyclohexa-2,5-dienyl]acetonitrile IUPAC Name: 2-[1-(4-hydroxy-3-methoxyphenyl)-3,5-dimethoxycyclohexa-2,5-dien-1-yl]acetonitrile Traditional Name: 2-[1-(4-hydroxy-3-methoxy-phenyl)-3,5-dimethoxy-cyclohexa-2,5-dien-1-yl]acetonitrile Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19NO4/c1-20-13-9-14(21-2)11-17(10-13,6-7-18)12-4-5-15(19)16(8-12)22-3/h4-5,8,10-11,19H,6,9H2,1-3H3