methyl 2,4-dimethyl-5-[2-(2-phenylbutanoyloxy)propanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-(2-phenylbutanoyloxy)propanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[2-(2-phenylbutanoyloxy)propanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-(1-oxo-2-phenylbutoxy)propyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-(2-phenylbutanoyloxy)propanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(2-phenylbutanoyloxy)propanoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OC(C)C(=O)C2=C(C(=C(N2)C)C(=O)OC)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)OC(C)C(=O)C2=C(C(=C(N2)C)C(=O)OC)C

InChI

InChI=1S/C21H25NO5/c1-6-16(15-10-8-7-9-11-15)20(24)27-14(4)19(23)18-12(2)17(13(3)22-18)21(25)26-5/h7-11,14,16,22H,6H2,1-5H3