2-[8-(3,4-dimethoxyphenyl)-1,4-dioxaspiro[4.5]dec-9-en-8-yl]ethanenitrile

Systemtic Name: 2-[8-(3,4-dimethoxyphenyl)-1,4-dioxaspiro[4.5]dec-9-en-8-yl]ethanenitrile Openeye Name: 2-[8-(3,4-dimethoxyphenyl)-1,4-dioxaspiro[4.5]dec-9-en-8-yl]acetonitrile CAS Name: 2-[8-(3,4-dimethoxyphenyl)-1,4-dioxaspiro[4.5]dec-9-en-8-yl]acetonitrile IUPAC Name: 2-[8-(3,4-dimethoxyphenyl)-1,4-dioxaspiro[4.5]dec-9-en-8-yl]acetonitrile Traditional Name: 2-[8-(3,4-dimethoxyphenyl)-1,4-dioxaspiro[4.5]dec-9-en-8-yl]acetonitrile Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC3(C=C2)OCCO3)CC#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC3(C=C2)OCCO3)CC#N)OC

InChI

InChI=1S/C18H21NO4/c1-20-15-4-3-14(13-16(15)21-2)17(9-10-19)5-7-18(8-6-17)22-11-12-23-18/h3-5,7,13H,6,8-9,11-12H2,1-2H3