2,2-dimethyl-4-[methyl(methylsulfonyl)amino]-3,4-dihydrochromene-6-carboxylic acid

Systemtic Name: 2,2-dimethyl-4-[methyl(methylsulfonyl)amino]-3,4-dihydrochromene-6-carboxylic acid Openeye Name: 2,2-dimethyl-4-[methyl(methylsulfonyl)amino]chromane-6-carboxylic acid CAS Name: 2,2-dimethyl-4-[methyl(methylsulfonyl)amino]-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid IUPAC Name: 2,2-dimethyl-4-[methyl(methylsulfonyl)amino]-3,4-dihydrochromene-6-carboxylic acid Traditional Name: 4-[mesyl(methyl)amino]-2,2-dimethyl-chroman-6-carboxylic acid Formula: C14H19NO5S MolecularWeight: 313.36936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(O1)C=CC(=C2)C(=O)O)N(C)S(=O)(=O)C)C

Isomeric SMILES

CC1(CC(C2=C(O1)C=CC(=C2)C(=O)O)N(C)S(=O)(=O)C)C

InChI

InChI=1S/C14H19NO5S/c1-14(2)8-11(15(3)21(4,18)19)10-7-9(13(16)17)5-6-12(10)20-14/h5-7,11H,8H2,1-4H3,(H,16,17)