2-methyl-2-(2-phenylprop-2-enoylamino)propane-1-sulfonic acid

Systemtic Name: 2-methyl-2-(2-phenylprop-2-enoylamino)propane-1-sulfonic acid Openeye Name: 2-methyl-2-(2-phenylprop-2-enoylamino)propane-1-sulfonic acid CAS Name: 2-methyl-2-[(1-oxo-2-phenylprop-2-enyl)amino]-1-propanesulfonic acid IUPAC Name: 2-methyl-2-(2-phenylprop-2-enoylamino)propane-1-sulfonic acid Traditional Name: 2-(atropoylamino)-2-methyl-propane-1-sulfonic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CS(=O)(=O)O)NC(=O)C(=C)C1=CC=CC=C1

Isomeric SMILES

CC(C)(CS(=O)(=O)O)NC(=O)C(=C)C1=CC=CC=C1

InChI

InChI=1S/C13H17NO4S/c1-10(11-7-5-4-6-8-11)12(15)14-13(2,3)9-19(16,17)18/h4-8H,1,9H2,2-3H3,(H,14,15)(H,16,17,18)