O2-tert-butyl O5-(phenylmethyl) 3-(3-methoxy-3-oxidanylidene-propyl)-4-methyl-1H-pyrrole-2,5-dicarboxylate

Systemtic Name: O2-tert-butyl O5-(phenylmethyl) 3-(3-methoxy-3-oxidanylidene-propyl)-4-methyl-1H-pyrrole-2,5-dicarboxylate Openeye Name: O5-benzyl O2-tert-butyl 3-(3-methoxy-3-oxo-propyl)-4-methyl-1H-pyrrole-2,5-dicarboxylate CAS Name: 3-(3-methoxy-3-oxopropyl)-4-methyl-1H-pyrrole-2,5-dicarboxylic acid O2-tert-butyl ester O5-(phenylmethyl) ester IUPAC Name: 5-O-benzyl 2-O-tert-butyl 3-(3-methoxy-3-oxopropyl)-4-methyl-1H-pyrrole-2,5-dicarboxylate Traditional Name: 3-(3-keto-3-methoxy-propyl)-4-methyl-1H-pyrrole-2,5-dicarboxylic acid O5-benzyl ester O2-tert-butyl ester Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CCC(=O)OC)C(=O)OC(C)(C)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=C(NC(=C1CCC(=O)OC)C(=O)OC(C)(C)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H27NO6/c1-14-16(11-12-17(24)27-5)19(21(26)29-22(2,3)4)23-18(14)20(25)28-13-15-9-7-6-8-10-15/h6-10,23H,11-13H2,1-5H3