[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromanylphenoxy)ethanoate

Systemtic Name: [2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromanylphenoxy)ethanoate Openeye Name: [2-(3,4-dimethoxyanilino)-2-oxo-ethyl] 2-(4-bromophenoxy)acetate CAS Name: 2-(4-bromophenoxy)acetic acid [2-(3,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethoxyanilino)-2-oxoethyl] 2-(4-bromophenoxy)acetate Traditional Name: 2-(4-bromophenoxy)acetic acid [2-(3,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C18H18BrNO6 MolecularWeight: 424.24262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)COC(=O)COC2=CC=C(C=C2)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)COC(=O)COC2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C18H18BrNO6/c1-23-15-8-5-13(9-16(15)24-2)20-17(21)10-26-18(22)11-25-14-6-3-12(19)4-7-14/h3-9H,10-11H2,1-2H3,(H,20,21)