ethyl 2,4-dimethyl-5-[(2S)-2-[(3S)-3-phenylbutanoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(2S)-2-[(3S)-3-phenylbutanoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(2S)-2-[(3S)-3-phenylbutanoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[(2S)-1-oxo-2-[(3S)-1-oxo-3-phenylbutoxy]propyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(2S)-2-[(3S)-3-phenylbutanoyl]oxypropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[(2S)-2-[(3S)-3-phenylbutanoyl]oxypropanoyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO5/c1-6-27-22(26)19-14(3)20(23-15(19)4)21(25)16(5)28-18(24)12-13(2)17-10-8-7-9-11-17/h7-11,13,16,23H,6,12H2,1-5H3/t13-,16-/m0/s1