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

Systemtic Name: 2-methyl-1-(2-methylpropyl)-5-phenyl-pyrrole-3-carboxylic acid Openeye Name: 1-isobutyl-2-methyl-5-phenyl-pyrrole-3-carboxylic acid CAS Name: 2-methyl-1-(2-methylpropyl)-5-phenyl-3-pyrrolecarboxylic acid IUPAC Name: 2-methyl-1-(2-methylpropyl)-5-phenylpyrrole-3-carboxylic acid Traditional Name: 1-isobutyl-2-methyl-5-phenyl-pyrrole-3-carboxylic acid Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CC(C)C)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1CC(C)C)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H19NO2/c1-11(2)10-17-12(3)14(16(18)19)9-15(17)13-7-5-4-6-8-13/h4-9,11H,10H2,1-3H3,(H,18,19)