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

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-(2-bromanyl-4,5-dimethoxy-phenyl)ethanoate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 2-(2-bromo-4,5-dimethoxy-phenyl)acetate CAS Name: 2-(2-bromo-4,5-dimethoxyphenyl)acetic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 2-(2-bromo-4,5-dimethoxyphenyl)acetate Traditional Name: 2-(2-bromo-4,5-dimethoxy-phenyl)acetic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C16H22BrNO5 MolecularWeight: 388.25358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22BrNO5/c1-5-10(2)18-15(19)9-23-16(20)7-11-6-13(21-3)14(22-4)8-12(11)17/h6,8,10H,5,7,9H2,1-4H3,(H,18,19)