2-[1-ethyl-5-(2,4,6-trimethylphenyl)carbonyl-pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[1-ethyl-5-(2,4,6-trimethylphenyl)carbonyl-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[1-ethyl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetic acid CAS Name: 2-[1-ethyl-5-[oxo-(2,4,6-trimethylphenyl)methyl]-2-pyrrolyl]acetic acid IUPAC Name: 2-[1-ethyl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetic acid Traditional Name: 2-[1-ethyl-5-(2,4,6-trimethylbenzoyl)pyrrol-2-yl]acetic acid Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=C1C(=O)C2=C(C=C(C=C2C)C)C)CC(=O)O

Isomeric SMILES

CCN1C(=CC=C1C(=O)C2=C(C=C(C=C2C)C)C)CC(=O)O

InChI

InChI=1S/C18H21NO3/c1-5-19-14(10-16(20)21)6-7-15(19)18(22)17-12(3)8-11(2)9-13(17)4/h6-9H,5,10H2,1-4H3,(H,20,21)