2-methyl-1-[2-(3-oxidanylidenepyrrolidin-2-yl)prop-2-enoylamino]propane-1-sulfonic acid

Systemtic Name: 2-methyl-1-[2-(3-oxidanylidenepyrrolidin-2-yl)prop-2-enoylamino]propane-1-sulfonic acid Openeye Name: 2-methyl-1-[2-(3-oxopyrrolidin-2-yl)prop-2-enoylamino]propane-1-sulfonic acid CAS Name: 2-methyl-1-[[1-oxo-2-(3-oxo-2-pyrrolidinyl)prop-2-enyl]amino]-1-propanesulfonic acid IUPAC Name: 2-methyl-1-[2-(3-oxopyrrolidin-2-yl)prop-2-enoylamino]propane-1-sulfonic acid Traditional Name: 1-[[2-(3-ketopyrrolidin-2-yl)acryloyl]amino]-2-methyl-propane-1-sulfonic acid Formula: C11H18N2O5S MolecularWeight: 290.33602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(NC(=O)C(=C)C1C(=O)CCN1)S(=O)(=O)O

Isomeric SMILES

CC(C)C(NC(=O)C(=C)C1C(=O)CCN1)S(=O)(=O)O

InChI

InChI=1S/C11H18N2O5S/c1-6(2)11(19(16,17)18)13-10(15)7(3)9-8(14)4-5-12-9/h6,9,11-12H,3-5H2,1-2H3,(H,13,15)(H,16,17,18)