tert-butyl (2S)-4-(4-methoxycarbonylphenyl)-5-oxidanyl-3-oxidanylidene-2-(phenylmethyl)-2H-pyrrole-1-carboxylate

Systemtic Name: tert-butyl (2S)-4-(4-methoxycarbonylphenyl)-5-oxidanyl-3-oxidanylidene-2-(phenylmethyl)-2H-pyrrole-1-carboxylate Openeye Name: tert-butyl (2S)-2-benzyl-5-hydroxy-4-(4-methoxycarbonylphenyl)-3-oxo-2H-pyrrole-1-carboxylate CAS Name: (2S)-5-hydroxy-4-(4-methoxycarbonylphenyl)-3-oxo-2-(phenylmethyl)-2H-pyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-benzyl-5-hydroxy-4-(4-methoxycarbonylphenyl)-3-oxo-2H-pyrrole-1-carboxylate Traditional Name: (2S)-2-benzyl-4-(4-carbomethoxyphenyl)-5-hydroxy-3-keto-2-pyrroline-1-carboxylic acid tert-butyl ester Formula: C24H25NO6 MolecularWeight: 423.4584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C(=O)C(=C1O)C2=CC=C(C=C2)C(=O)OC)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@H](C(=O)C(=C1O)C2=CC=C(C=C2)C(=O)OC)CC3=CC=CC=C3

InChI

InChI=1S/C24H25NO6/c1-24(2,3)31-23(29)25-18(14-15-8-6-5-7-9-15)20(26)19(21(25)27)16-10-12-17(13-11-16)22(28)30-4/h5-13,18,27H,14H2,1-4H3/t18-/m0/s1