5-methyl-4-phenyl-pyrrole-2,2-dicarboxylic acid

Systemtic Name: 5-methyl-4-phenyl-pyrrole-2,2-dicarboxylic acid Openeye Name: 5-methyl-4-phenyl-pyrrole-2,2-dicarboxylic acid CAS Name: 5-methyl-4-phenylpyrrole-2,2-dicarboxylic acid IUPAC Name: 5-methyl-4-phenylpyrrole-2,2-dicarboxylic acid Traditional Name: 5-methyl-4-phenyl-pyrrole-2,2-dicarboxylic acid Formula: C13H11NO4 MolecularWeight: 245.23074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(C=C1C2=CC=CC=C2)(C(=O)O)C(=O)O

Isomeric SMILES

CC1=NC(C=C1C2=CC=CC=C2)(C(=O)O)C(=O)O

InChI

InChI=1S/C13H11NO4/c1-8-10(9-5-3-2-4-6-9)7-13(14-8,11(15)16)12(17)18/h2-7H,1H3,(H,15,16)(H,17,18)