2,2-dimethyl-3-oxidanylidene-3-[(2-pyrrol-1-ylsulfonylphenyl)amino]propanoic acid

Systemtic Name: 2,2-dimethyl-3-oxidanylidene-3-[(2-pyrrol-1-ylsulfonylphenyl)amino]propanoic acid Openeye Name: 2,2-dimethyl-3-oxo-3-(2-pyrrol-1-ylsulfonylanilino)propanoic acid CAS Name: 2,2-dimethyl-3-oxo-3-[2-(1-pyrrolylsulfonyl)anilino]propanoic acid IUPAC Name: 2,2-dimethyl-3-oxo-3-(2-pyrrol-1-ylsulfonylanilino)propanoic acid Traditional Name: 3-keto-2,2-dimethyl-3-(2-pyrrol-1-ylsulfonylanilino)propionic acid Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC=CC=C1S(=O)(=O)N2C=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C(=O)NC1=CC=CC=C1S(=O)(=O)N2C=CC=C2)C(=O)O

InChI

InChI=1S/C15H16N2O5S/c1-15(2,14(19)20)13(18)16-11-7-3-4-8-12(11)23(21,22)17-9-5-6-10-17/h3-10H,1-2H3,(H,16,18)(H,19,20)