[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-(2-bromanyl-4,5-dimethoxy-phenyl)ethanoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-(2-bromanyl-4,5-dimethoxy-phenyl)ethanoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-(2-bromo-4,5-dimethoxy-phenyl)acetate CAS Name: 2-(2-bromo-4,5-dimethoxyphenyl)acetic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-(2-bromo-4,5-dimethoxyphenyl)acetate Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)acetic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C17H24BrNO5 MolecularWeight: 402.28016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)CC1=CC(=C(C=C1Br)OC)OC

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)CC1=CC(=C(C=C1Br)OC)OC

InChI

InChI=1S/C17H24BrNO5/c1-5-12(6-2)19-16(20)10-24-17(21)8-11-7-14(22-3)15(23-4)9-13(11)18/h7,9,12H,5-6,8,10H2,1-4H3,(H,19,20)