O1-tert-butyl O2-methyl (2S)-4-(4-tert-butylphenyl)-2,3-dihydropyrrole-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-methyl (2S)-4-(4-tert-butylphenyl)-2,3-dihydropyrrole-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl (2S)-4-(4-tert-butylphenyl)-2,3-dihydropyrrole-1,2-dicarboxylate CAS Name: (2S)-4-(4-tert-butylphenyl)-2,3-dihydropyrrole-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester IUPAC Name: 1-O-tert-butyl 2-O-methyl (2S)-4-(4-tert-butylphenyl)-2,3-dihydropyrrole-1,2-dicarboxylate Traditional Name: (2S)-4-(4-tert-butylphenyl)-2-pyrroline-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CN(C(C2)C(=O)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CN([C@@H](C2)C(=O)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H29NO4/c1-20(2,3)16-10-8-14(9-11-16)15-12-17(18(23)25-7)22(13-15)19(24)26-21(4,5)6/h8-11,13,17H,12H2,1-7H3/t17-/m0/s1