tert-butyl (2S)-4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-5-oxidanyl-3-oxidanylidene-2-(phenylmethyl)-2H-pyrrole-1-carboxylate

Systemtic Name: tert-butyl (2S)-4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-5-oxidanyl-3-oxidanylidene-2-(phenylmethyl)-2H-pyrrole-1-carboxylate Openeye Name: tert-butyl (2S)-2-benzyl-4-[4-(tert-butoxycarbonylamino)phenyl]-5-hydroxy-3-oxo-2H-pyrrole-1-carboxylate CAS Name: (2S)-5-hydroxy-4-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]-3-oxo-2-(phenylmethyl)-2H-pyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-benzyl-5-hydroxy-4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-3-oxo-2H-pyrrole-1-carboxylate Traditional Name: (2S)-2-benzyl-4-[4-(tert-butoxycarbonylamino)phenyl]-5-hydroxy-3-keto-2-pyrroline-1-carboxylic acid tert-butyl ester Formula: C27H32N2O6 MolecularWeight: 480.55278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C2=C(N(C(C2=O)CC3=CC=CC=C3)C(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C2=C(N([C@H](C2=O)CC3=CC=CC=C3)C(=O)OC(C)(C)C)O

InChI

InChI=1S/C27H32N2O6/c1-26(2,3)34-24(32)28-19-14-12-18(13-15-19)21-22(30)20(16-17-10-8-7-9-11-17)29(23(21)31)25(33)35-27(4,5)6/h7-15,20,31H,16H2,1-6H3,(H,28,32)/t20-/m0/s1