3,5-dimethyl-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 3,5-dimethyl-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[(E)-3-hydroxy-3-oxo-prop-1-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-[(E)-3-hydroxy-3-oxoprop-1-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[(E)-3-hydroxy-3-oxoprop-1-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[(E)-3-hydroxy-3-keto-prop-1-enyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid Formula: C10H11NO4 MolecularWeight: 209.19864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(NC(=C1/C=C/C(=O)O)C)C(=O)O

InChI

InChI=1S/C10H11NO4/c1-5-7(3-4-8(12)13)6(2)11-9(5)10(14)15/h3-4,11H,1-2H3,(H,12,13)(H,14,15)/b4-3+