3-[(1-methylpyrrol-3-yl)sulfonylamino]-3-phenyl-propanoic acid

Systemtic Name: 3-[(1-methylpyrrol-3-yl)sulfonylamino]-3-phenyl-propanoic acid Openeye Name: 3-[(1-methylpyrrol-3-yl)sulfonylamino]-3-phenyl-propanoic acid CAS Name: 3-[(1-methyl-3-pyrrolyl)sulfonylamino]-3-phenylpropanoic acid IUPAC Name: 3-[(1-methylpyrrol-3-yl)sulfonylamino]-3-phenylpropanoic acid Traditional Name: 3-[(1-methylpyrrol-3-yl)sulfonylamino]-3-phenyl-propionic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)S(=O)(=O)NC(CC(=O)O)C2=CC=CC=C2

Isomeric SMILES

CN1C=CC(=C1)S(=O)(=O)NC(CC(=O)O)C2=CC=CC=C2

InChI

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