4-[2-[(1-methylpyrrol-3-yl)sulfonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[(1-methylpyrrol-3-yl)sulfonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[(1-methylpyrrol-3-yl)sulfonylamino]ethyl]benzoic acid CAS Name: 4-[2-[(1-methyl-3-pyrrolyl)sulfonylamino]ethyl]benzoic acid IUPAC Name: 4-[2-[(1-methylpyrrol-3-yl)sulfonylamino]ethyl]benzoic acid Traditional Name: 4-[2-[(1-methylpyrrol-3-yl)sulfonylamino]ethyl]benzoic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN1C=CC(=C1)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H16N2O4S/c1-16-9-7-13(10-16)21(19,20)15-8-6-11-2-4-12(5-3-11)14(17)18/h2-5,7,9-10,15H,6,8H2,1H3,(H,17,18)