2-(7-methoxy-3-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanesulfonic acid

Systemtic Name: 2-(7-methoxy-3-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanesulfonic acid Openeye Name: 2-(7-methoxy-3-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanesulfonic acid CAS Name: 2-(7-methoxy-3-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanesulfonic acid IUPAC Name: 2-(7-methoxy-3-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanesulfonic acid Traditional Name: 2-(7-methoxy-3-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanesulfonic acid Formula: C12H17NO5S MolecularWeight: 287.33208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1COC2=C(N1CCS(=O)(=O)O)C=CC(=C2)OC

Isomeric SMILES

CC1COC2=C(N1CCS(=O)(=O)O)C=CC(=C2)OC

InChI

InChI=1S/C12H17NO5S/c1-9-8-18-12-7-10(17-2)3-4-11(12)13(9)5-6-19(14,15)16/h3-4,7,9H,5-6,8H2,1-2H3,(H,14,15,16)