5-methyl-3-(3-phenylpyrrol-1-yl)carbonyl-hexanoic acid

Systemtic Name: 5-methyl-3-(3-phenylpyrrol-1-yl)carbonyl-hexanoic acid Openeye Name: 5-methyl-3-(3-phenylpyrrole-1-carbonyl)hexanoic acid CAS Name: 5-methyl-3-[oxo-(3-phenyl-1-pyrrolyl)methyl]hexanoic acid IUPAC Name: 5-methyl-3-(3-phenylpyrrole-1-carbonyl)hexanoic acid Traditional Name: 5-methyl-3-(3-phenylpyrrole-1-carbonyl)hexanoic acid Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)O)C(=O)N1C=CC(=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)CC(CC(=O)O)C(=O)N1C=CC(=C1)C2=CC=CC=C2

InChI

InChI=1S/C18H21NO3/c1-13(2)10-16(11-17(20)21)18(22)19-9-8-15(12-19)14-6-4-3-5-7-14/h3-9,12-13,16H,10-11H2,1-2H3,(H,20,21)