[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)ethanoate

Systemtic Name: [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)ethanoate Openeye Name: [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl] 2-(4-bromo-2-chloro-6-methyl-phenoxy)acetate CAS Name: 2-(4-bromo-2-chloro-6-methylphenoxy)acetic acid [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] 2-(4-bromo-2-chloro-6-methylphenoxy)acetate Traditional Name: 2-(4-bromo-2-chloro-6-methyl-phenoxy)acetic acid [2-[bis(2-cyanoethyl)amino]-2-keto-ethyl] ester Formula: C17H17BrClN3O4 MolecularWeight: 442.69158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)OCC(=O)N(CCC#N)CCC#N)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)OCC(=O)N(CCC#N)CCC#N)Cl)Br

InChI

InChI=1S/C17H17BrClN3O4/c1-12-8-13(18)9-14(19)17(12)26-11-16(24)25-10-15(23)22(6-2-4-20)7-3-5-21/h8-9H,2-3,6-7,10-11H2,1H3