O1-[(4-bromophenyl)methyl] O4-cyclopentyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate

Systemtic Name: O1-[(4-bromophenyl)methyl] O4-cyclopentyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Openeye Name: O1-[(4-bromophenyl)methyl] O4-cyclopentyl (2S)-2-(tert-butoxycarbonylamino)butanedioate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanedioic acid O1-[(4-bromophenyl)methyl] ester O4-cyclopentyl ester IUPAC Name: 1-O-[(4-bromophenyl)methyl] 4-O-cyclopentyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)succinic acid O1-(4-bromobenzyl) ester O4-cyclopentyl ester Formula: C21H28BrNO6 MolecularWeight: 470.35412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)OC1CCCC1)C(=O)OCC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC(=O)OC1CCCC1)C(=O)OCC2=CC=C(C=C2)Br

InChI

InChI=1S/C21H28BrNO6/c1-21(2,3)29-20(26)23-17(12-18(24)28-16-6-4-5-7-16)19(25)27-13-14-8-10-15(22)11-9-14/h8-11,16-17H,4-7,12-13H2,1-3H3,(H,23,26)/t17-/m0/s1