[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3,5-dimethoxybenzoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3,5-dimethoxybenzoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 3,5-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H16N2O5 MolecularWeight: 292.28724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)OCC(=O)NCCC#N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)OCC(=O)NCCC#N)OC

InChI

InChI=1S/C14H16N2O5/c1-19-11-6-10(7-12(8-11)20-2)14(18)21-9-13(17)16-5-3-4-15/h6-8H,3,5,9H2,1-2H3,(H,16,17)