2-[methyl-(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)carbonyl-amino]ethanoic acid

Systemtic Name: 2-[methyl-(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)carbonyl-amino]ethanoic acid Openeye Name: 2-[methyl-(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carbonyl)amino]acetic acid CAS Name: 2-[methyl-[[1-methyl-4-(1-pyrrolidinylsulfonyl)-2-pyrrolyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[methyl-(1-methyl-4-pyrrolidin-1-ylsulfonylpyrrole-2-carbonyl)amino]acetic acid Traditional Name: 2-[methyl-(1-methyl-4-pyrrolidinosulfonyl-pyrrole-2-carbonyl)amino]acetic acid Formula: C13H19N3O5S MolecularWeight: 329.37206

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N(C)CC(=O)O)S(=O)(=O)N2CCCC2

Isomeric SMILES

CN1C=C(C=C1C(=O)N(C)CC(=O)O)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C13H19N3O5S/c1-14-8-10(22(20,21)16-5-3-4-6-16)7-11(14)13(19)15(2)9-12(17)18/h7-8H,3-6,9H2,1-2H3,(H,17,18)