[2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 2-(2-nitrophenoxy)ethanoate

Systemtic Name: [2-[2-cyanoethyl(methyl)amino]-2-oxidanylidene-ethyl] 2-(2-nitrophenoxy)ethanoate Openeye Name: [2-[2-cyanoethyl(methyl)amino]-2-oxo-ethyl] 2-(2-nitrophenoxy)acetate CAS Name: 2-(2-nitrophenoxy)acetic acid [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(methyl)amino]-2-oxoethyl] 2-(2-nitrophenoxy)acetate Traditional Name: 2-(2-nitrophenoxy)acetic acid [2-[2-cyanoethyl(methyl)amino]-2-keto-ethyl] ester Formula: C14H15N3O6 MolecularWeight: 321.2854

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)COC(=O)COC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CN(CCC#N)C(=O)COC(=O)COC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O6/c1-16(8-4-7-15)13(18)9-23-14(19)10-22-12-6-3-2-5-11(12)17(20)21/h2-3,5-6H,4,8-10H2,1H3