5-(4-ethoxyphenyl)-2-methyl-1-(2-methylpropyl)pyrrole-3-carboxylic acid

Systemtic Name: 5-(4-ethoxyphenyl)-2-methyl-1-(2-methylpropyl)pyrrole-3-carboxylic acid Openeye Name: 5-(4-ethoxyphenyl)-1-isobutyl-2-methyl-pyrrole-3-carboxylic acid CAS Name: 5-(4-ethoxyphenyl)-2-methyl-1-(2-methylpropyl)-3-pyrrolecarboxylic acid IUPAC Name: 5-(4-ethoxyphenyl)-2-methyl-1-(2-methylpropyl)pyrrole-3-carboxylic acid Traditional Name: 1-isobutyl-2-methyl-5-p-phenetyl-pyrrole-3-carboxylic acid Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=C(N2CC(C)C)C)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC(=C(N2CC(C)C)C)C(=O)O

InChI

InChI=1S/C18H23NO3/c1-5-22-15-8-6-14(7-9-15)17-10-16(18(20)21)13(4)19(17)11-12(2)3/h6-10,12H,5,11H2,1-4H3,(H,20,21)