ethyl 2,5-dimethyl-4-[2-[(2R)-2-phenoxybutanoyl]oxyethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-[(2R)-2-phenoxybutanoyl]oxyethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-[(2R)-2-phenoxybutanoyl]oxyacetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[1-oxo-2-[(2R)-1-oxo-2-phenoxybutoxy]ethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-[(2R)-2-phenoxybutanoyl]oxyacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-4-[2-[(2R)-2-phenoxybutanoyl]oxyacetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC(=O)C1=C(NC(=C1C(=O)OCC)C)C)OC2=CC=CC=C2

Isomeric SMILES

CC[C@H](C(=O)OCC(=O)C1=C(NC(=C1C(=O)OCC)C)C)OC2=CC=CC=C2

InChI

InChI=1S/C21H25NO6/c1-5-17(28-15-10-8-7-9-11-15)20(24)27-12-16(23)18-13(3)22-14(4)19(18)21(25)26-6-2/h7-11,17,22H,5-6,12H2,1-4H3/t17-/m1/s1