4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(1-hydroxyethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Formula: C9H13NO3 MolecularWeight: 183.20442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(C)O)C)C(=O)O

Isomeric SMILES

CC1=C(NC(=C1C(C)O)C)C(=O)O

InChI

InChI=1S/C9H13NO3/c1-4-7(6(3)11)5(2)10-8(4)9(12)13/h6,10-11H,1-3H3,(H,12,13)