3-sulfonylpropanoic acid; 2,2,6,6-tetramethyl-1,3-dihydropyridine

Systemtic Name: 3-sulfonylpropanoic acid; 2,2,6,6-tetramethyl-1,3-dihydropyridine Openeye Name: 3-sulfonylpropanoic acid; 2,2,6,6-tetramethyl-1,3-dihydropyridine CAS Name: 3-sulfonylpropanoic acid; 2,2,6,6-tetramethyl-1,3-dihydropyridine IUPAC Name: 3-sulfonylpropanoic acid; 2,2,6,6-tetramethyl-1,3-dihydropyridine Traditional Name: 3-sulfonylpropionic acid; 2,2,6,6-tetramethyl-1,3-dihydropyridine Formula: C12H21NO4S MolecularWeight: 275.36444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=CC(N1)(C)C)C.C(C=S(=O)=O)C(=O)O

Isomeric SMILES

CC1(CC=CC(N1)(C)C)C.C(C=S(=O)=O)C(=O)O

InChI

InChI=1S/C9H17N.C3H4O4S/c1-8(2)6-5-7-9(3,4)10-8;4-3(5)1-2-8(6)7/h5-6,10H,7H2,1-4H3;2H,1H2,(H,4,5)