(phenylmethyl) 3-[1-(2-bromanyl-4,5-dimethoxy-phenyl)carbonylpiperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: (phenylmethyl) 3-[1-(2-bromanyl-4,5-dimethoxy-phenyl)carbonylpiperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: benzyl 3-[1-(2-bromo-4,5-dimethoxy-benzoyl)-4-piperidyl]-2-oxo-oxazolidine-4-carboxylate CAS Name: 3-[1-[(2-bromo-4,5-dimethoxyphenyl)-oxomethyl]-4-piperidinyl]-2-oxo-4-oxazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[1-(2-bromo-4,5-dimethoxybenzoyl)piperidin-4-yl]-2-oxo-1,3-oxazolidine-4-carboxylate Traditional Name: 3-[1-(2-bromo-4,5-dimethoxy-benzoyl)-4-piperidyl]-2-keto-oxazolidine-4-carboxylic acid benzyl ester Formula: C25H27BrN2O7 MolecularWeight: 547.39508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)N3C(COC3=O)C(=O)OCC4=CC=CC=C4)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCC(CC2)N3C(COC3=O)C(=O)OCC4=CC=CC=C4)Br)OC

InChI

InChI=1S/C25H27BrN2O7/c1-32-21-12-18(19(26)13-22(21)33-2)23(29)27-10-8-17(9-11-27)28-20(15-35-25(28)31)24(30)34-14-16-6-4-3-5-7-16/h3-7,12-13,17,20H,8-11,14-15H2,1-2H3