2-[2-(hydroxymethyl)-5-methanoyl-pyrrol-1-yl]-3-methyl-butanoic acid

Systemtic Name: 2-[2-(hydroxymethyl)-5-methanoyl-pyrrol-1-yl]-3-methyl-butanoic acid Openeye Name: 2-[2-formyl-5-(hydroxymethyl)pyrrol-1-yl]-3-methyl-butanoic acid CAS Name: 2-[2-formyl-5-(hydroxymethyl)-1-pyrrolyl]-3-methylbutanoic acid IUPAC Name: 2-[2-formyl-5-(hydroxymethyl)pyrrol-1-yl]-3-methylbutanoic acid Traditional Name: 2-(2-formyl-5-methylol-pyrrol-1-yl)-3-methyl-butyric acid Formula: C11H15NO4 MolecularWeight: 225.2411

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N1C(=CC=C1C=O)CO

Isomeric SMILES

CC(C)C(C(=O)O)N1C(=CC=C1C=O)CO

InChI

InChI=1S/C11H15NO4/c1-7(2)10(11(15)16)12-8(5-13)3-4-9(12)6-14/h3-5,7,10,14H,6H2,1-2H3,(H,15,16)