[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3,4,5-trimethoxybenzoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C15H18N2O6/c1-20-11-7-10(8-12(21-2)14(11)22-3)15(19)23-9-13(18)17-6-4-5-16/h7-8H,4,6,9H2,1-3H3,(H,17,18)