3-(7-methoxy-2,3-dimethyl-quinoxalin-6-yl)oxypropane-1-sulfonic acid

Systemtic Name: 3-(7-methoxy-2,3-dimethyl-quinoxalin-6-yl)oxypropane-1-sulfonic acid Openeye Name: 3-(7-methoxy-2,3-dimethyl-quinoxalin-6-yl)oxypropane-1-sulfonic acid CAS Name: 3-[(7-methoxy-2,3-dimethyl-6-quinoxalinyl)oxy]-1-propanesulfonic acid IUPAC Name: 3-(7-methoxy-2,3-dimethylquinoxalin-6-yl)oxypropane-1-sulfonic acid Traditional Name: 3-(7-methoxy-2,3-dimethyl-quinoxalin-6-yl)oxypropane-1-sulfonic acid Formula: C14H18N2O5S MolecularWeight: 326.36812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C=C2N=C1C)OCCCS(=O)(=O)O)OC

Isomeric SMILES

CC1=NC2=CC(=C(C=C2N=C1C)OCCCS(=O)(=O)O)OC

InChI

InChI=1S/C14H18N2O5S/c1-9-10(2)16-12-8-14(13(20-3)7-11(12)15-9)21-5-4-6-22(17,18)19/h7-8H,4-6H2,1-3H3,(H,17,18,19)