O2-(4-oxidanylidene-4-phenyl-butyl) O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-(4-oxidanylidene-4-phenyl-butyl) O4-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-isopropyl O2-(4-oxo-4-phenyl-butyl) 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O2-(4-oxo-4-phenylbutyl) ester O4-propan-2-yl ester IUPAC Name: 2-O-(4-oxo-4-phenylbutyl) 4-O-propan-2-yl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-isopropyl ester O2-(4-keto-4-phenyl-butyl) ester Formula: C21H25NO5 MolecularWeight: 371.4269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCCCC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)OCCCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H25NO5/c1-13(2)27-20(24)18-14(3)19(22-15(18)4)21(25)26-12-8-11-17(23)16-9-6-5-7-10-16/h5-7,9-10,13,22H,8,11-12H2,1-4H3