2-(2-methoxy-2-oxidanylidene-ethyl)-1-methyl-pyrrole-3-carboxylic acid

Systemtic Name: 2-(2-methoxy-2-oxidanylidene-ethyl)-1-methyl-pyrrole-3-carboxylic acid Openeye Name: 2-(2-methoxy-2-oxo-ethyl)-1-methyl-pyrrole-3-carboxylic acid CAS Name: 2-(2-methoxy-2-oxoethyl)-1-methyl-3-pyrrolecarboxylic acid IUPAC Name: 2-(2-methoxy-2-oxoethyl)-1-methylpyrrole-3-carboxylic acid Traditional Name: 2-(2-keto-2-methoxy-ethyl)-1-methyl-pyrrole-3-carboxylic acid Formula: C9H11NO4 MolecularWeight: 197.18794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1CC(=O)OC)C(=O)O

Isomeric SMILES

CN1C=CC(=C1CC(=O)OC)C(=O)O

InChI

InChI=1S/C9H11NO4/c1-10-4-3-6(9(12)13)7(10)5-8(11)14-2/h3-4H,5H2,1-2H3,(H,12,13)