4-methoxycarbonyl-1,2,5-trimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 4-methoxycarbonyl-1,2,5-trimethyl-pyrrole-3-carboxylic acid Openeye Name: 4-methoxycarbonyl-1,2,5-trimethyl-pyrrole-3-carboxylic acid CAS Name: 4-methoxycarbonyl-1,2,5-trimethyl-3-pyrrolecarboxylic acid IUPAC Name: 4-methoxycarbonyl-1,2,5-trimethylpyrrole-3-carboxylic acid Traditional Name: 4-carbomethoxy-1,2,5-trimethyl-pyrrole-3-carboxylic acid Formula: C10H13NO4 MolecularWeight: 211.21452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)C(=O)OC)C(=O)O

Isomeric SMILES

CC1=C(C(=C(N1C)C)C(=O)OC)C(=O)O

InChI

InChI=1S/C10H13NO4/c1-5-7(9(12)13)8(10(14)15-4)6(2)11(5)3/h1-4H3,(H,12,13)