[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 3,5-dimethoxybenzoate

Systemtic Name: [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 3,5-dimethoxybenzoate Openeye Name: [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl] 3,5-dimethoxybenzoate CAS Name: 3,5-dimethoxybenzoic acid [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] 3,5-dimethoxybenzoate Traditional Name: 3,5-dimethoxybenzoic acid [2-[bis(2-cyanoethyl)amino]-2-keto-ethyl] ester Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O5/c1-23-14-9-13(10-15(11-14)24-2)17(22)25-12-16(21)20(7-3-5-18)8-4-6-19/h9-11H,3-4,7-8,12H2,1-2H3