(1-cyanocyclohexyl) 3,4,5-trimethoxybenzoate

Systemtic Name: (1-cyanocyclohexyl) 3,4,5-trimethoxybenzoate Openeye Name: (1-cyanocyclohexyl) 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid (1-cyanocyclohexyl) ester IUPAC Name: (1-cyanocyclohexyl) 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid (1-cyanocyclohexyl) ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OC2(CCCCC2)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OC2(CCCCC2)C#N

InChI

InChI=1S/C17H21NO5/c1-20-13-9-12(10-14(21-2)15(13)22-3)16(19)23-17(11-18)7-5-4-6-8-17/h9-10H,4-8H2,1-3H3