[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 2,4-dimethoxybenzoate

Systemtic Name: [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 2,4-dimethoxybenzoate Openeye Name: [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl] 2,4-dimethoxybenzoate CAS Name: 2,4-dimethoxybenzoic acid [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] 2,4-dimethoxybenzoate Traditional Name: 2,4-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(=C(C=C1)C(=O)OCC(=O)N(CCC#N)CCC#N)OC

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O5/c1-23-13-5-6-14(15(11-13)24-2)17(22)25-12-16(21)20(9-3-7-18)10-4-8-19/h5-6,11H,3-4,9-10,12H2,1-2H3