6-methyl-3-oxidanylidene-6-pyrrol-1-yl-cyclohexa-1,4-diene-1-carboxylic acid

Systemtic Name: 6-methyl-3-oxidanylidene-6-pyrrol-1-yl-cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: 6-methyl-3-oxo-6-pyrrol-1-yl-cyclohexa-1,4-diene-1-carboxylic acid CAS Name: 6-methyl-3-oxo-6-(1-pyrrolyl)-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: 6-methyl-3-oxo-6-pyrrol-1-ylcyclohexa-1,4-diene-1-carboxylic acid Traditional Name: 3-keto-6-methyl-6-pyrrol-1-yl-cyclohexa-1,4-diene-1-carboxylic acid Formula: C12H11NO3 MolecularWeight: 217.22064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(=O)C=C1C(=O)O)N2C=CC=C2

Isomeric SMILES

CC1(C=CC(=O)C=C1C(=O)O)N2C=CC=C2

InChI

InChI=1S/C12H11NO3/c1-12(13-6-2-3-7-13)5-4-9(14)8-10(12)11(15)16/h2-8H,1H3,(H,15,16)