2-[1-methyl-5-[2-[(phenylmethyl)sulfonylamino]ethyl]pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[1-methyl-5-[2-[(phenylmethyl)sulfonylamino]ethyl]pyrrol-2-yl]ethanoic acid Openeye Name: 2-[5-[2-(benzylsulfonylamino)ethyl]-1-methyl-pyrrol-2-yl]acetic acid CAS Name: 2-[1-methyl-5-[2-[(phenylmethyl)sulfonylamino]ethyl]-2-pyrrolyl]acetic acid IUPAC Name: 2-[5-[2-(benzylsulfonylamino)ethyl]-1-methylpyrrol-2-yl]acetic acid Traditional Name: 2-[5-[2-(benzylsulfonylamino)ethyl]-1-methyl-pyrrol-2-yl]acetic acid Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1CC(=O)O)CCNS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CN1C(=CC=C1CC(=O)O)CCNS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C16H20N2O4S/c1-18-14(7-8-15(18)11-16(19)20)9-10-17-23(21,22)12-13-5-3-2-4-6-13/h2-8,17H,9-12H2,1H3,(H,19,20)