O4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] O1-tert-butyl piperidine-1,4-dicarboxylate

Systemtic Name: O4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] O1-tert-butyl piperidine-1,4-dicarboxylate Openeye Name: O4-[2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl] O1-tert-butyl piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O4-[2-(4-bromo-3-methylanilino)-2-oxoethyl] ester O1-tert-butyl ester IUPAC Name: 4-O-[2-(4-bromo-3-methylanilino)-2-oxoethyl] 1-O-tert-butyl piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O4-[2-(4-bromo-3-methyl-anilino)-2-keto-ethyl] ester O1-tert-butyl ester Formula: C20H27BrN2O5 MolecularWeight: 455.34278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)Br

InChI

InChI=1S/C20H27BrN2O5/c1-13-11-15(5-6-16(13)21)22-17(24)12-27-18(25)14-7-9-23(10-8-14)19(26)28-20(2,3)4/h5-6,11,14H,7-10,12H2,1-4H3,(H,22,24)