[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 2-phenoxyethanoate

Systemtic Name: [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 2-phenoxyethanoate Openeye Name: [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl] 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid [2-[bis(2-cyanoethyl)amino]-2-keto-ethyl] ester Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O4/c17-8-4-10-19(11-5-9-18)15(20)12-23-16(21)13-22-14-6-2-1-3-7-14/h1-3,6-7H,4-5,10-13H2