ethyl 2,4-dimethyl-5-[(2R)-2-(4-oxidanylidene-4-phenyl-butanoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(2R)-2-(4-oxidanylidene-4-phenyl-butanoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(2R)-2-(4-oxo-4-phenyl-butanoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 5-[(2R)-2-(1,4-dioxo-4-phenylbutoxy)-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(2R)-2-(4-oxo-4-phenylbutanoyl)oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2R)-2-(4-keto-4-phenyl-butanoyl)oxypropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H25NO6 MolecularWeight: 399.437

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)OC(=O)CCC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)[C@@H](C)OC(=O)CCC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C22H25NO6/c1-5-28-22(27)19-13(2)20(23-14(19)3)21(26)15(4)29-18(25)12-11-17(24)16-9-7-6-8-10-16/h6-10,15,23H,5,11-12H2,1-4H3/t15-/m1/s1