1-[4-[4-(3-carboxy-2,5-dimethyl-pyrrol-1-yl)phenyl]sulfonylphenyl]-2,5-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-[4-[4-(3-carboxy-2,5-dimethyl-pyrrol-1-yl)phenyl]sulfonylphenyl]-2,5-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 1-[4-[4-(3-carboxy-2,5-dimethyl-pyrrol-1-yl)phenyl]sulfonylphenyl]-2,5-dimethyl-pyrrole-3-carboxylic acid CAS Name: 1-[4-[4-(3-carboxy-2,5-dimethyl-1-pyrrolyl)phenyl]sulfonylphenyl]-2,5-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 1-[4-[4-(3-carboxy-2,5-dimethylpyrrol-1-yl)phenyl]sulfonylphenyl]-2,5-dimethylpyrrole-3-carboxylic acid Traditional Name: 1-[4-[4-(3-carboxy-2,5-dimethyl-pyrrol-1-yl)phenyl]sulfonylphenyl]-2,5-dimethyl-pyrrole-3-carboxylic acid Formula: C26H24N2O6S MolecularWeight: 492.54356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)N4C(=CC(=C4C)C(=O)O)C)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)N4C(=CC(=C4C)C(=O)O)C)C)C(=O)O

InChI

InChI=1S/C26H24N2O6S/c1-15-13-23(25(29)30)17(3)27(15)19-5-9-21(10-6-19)35(33,34)22-11-7-20(8-12-22)28-16(2)14-24(18(28)4)26(31)32/h5-14H,1-4H3,(H,29,30)(H,31,32)