2-azanyl-2-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-2-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-2-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-5-oxo-pentanoic acid CAS Name: 2-amino-2-(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-5-oxopentanoic acid IUPAC Name: 2-amino-2-(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-5-oxopentanoic acid Traditional Name: 2-amino-5-keto-2-(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-valeric acid Formula: C15H21NO6S MolecularWeight: 343.39534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1S(=O)(=O)C(CCC=O)(C(=O)O)N)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1S(=O)(=O)C(CCC=O)(C(=O)O)N)C)C)OC

InChI

InChI=1S/C15H21NO6S/c1-9-8-12(22-4)10(2)11(3)13(9)23(20,21)15(16,14(18)19)6-5-7-17/h7-8H,5-6,16H2,1-4H3,(H,18,19)