1-(2,2,2-trimethoxyethyl)cyclohexa-2,5-diene-1-carbonitrile

Systemtic Name: 1-(2,2,2-trimethoxyethyl)cyclohexa-2,5-diene-1-carbonitrile Openeye Name: 1-(2,2,2-trimethoxyethyl)cyclohexa-2,5-diene-1-carbonitrile CAS Name: 1-(2,2,2-trimethoxyethyl)-1-cyclohexa-2,5-dienecarbonitrile IUPAC Name: 1-(2,2,2-trimethoxyethyl)cyclohexa-2,5-diene-1-carbonitrile Traditional Name: 1-(2,2,2-trimethoxyethyl)cyclohexa-2,5-diene-1-carbonitrile Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC1(C=CCC=C1)C#N)(OC)OC

Isomeric SMILES

COC(CC1(C=CCC=C1)C#N)(OC)OC

InChI

InChI=1S/C12H17NO3/c1-14-12(15-2,16-3)9-11(10-13)7-5-4-6-8-11/h5-8H,4,9H2,1-3H3