ethyl 1,3,5-trimethyl-4-[2-(2-propan-2-ylphenoxy)ethanoyl]pyrrole-2-carboxylate

Systemtic Name: ethyl 1,3,5-trimethyl-4-[2-(2-propan-2-ylphenoxy)ethanoyl]pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-(2-isopropylphenoxy)acetyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 1,3,5-trimethyl-4-[1-oxo-2-(2-propan-2-ylphenoxy)ethyl]-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,3,5-trimethyl-4-[2-(2-propan-2-ylphenoxy)acetyl]pyrrole-2-carboxylate Traditional Name: 4-[2-(2-isopropylphenoxy)acetyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)COC2=CC=CC=C2C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)COC2=CC=CC=C2C(C)C)C

InChI

InChI=1S/C21H27NO4/c1-7-25-21(24)20-14(4)19(15(5)22(20)6)17(23)12-26-18-11-9-8-10-16(18)13(2)3/h8-11,13H,7,12H2,1-6H3