3-(4-methyl-4H-quinolin-1-yl)propane-1-sulfonic acid

Systemtic Name: 3-(4-methyl-4H-quinolin-1-yl)propane-1-sulfonic acid Openeye Name: 3-(4-methyl-4H-quinolin-1-yl)propane-1-sulfonic acid CAS Name: 3-(4-methyl-4H-quinolin-1-yl)-1-propanesulfonic acid IUPAC Name: 3-(4-methyl-4H-quinolin-1-yl)propane-1-sulfonic acid Traditional Name: 3-(4-methyl-4H-quinolin-1-yl)propane-1-sulfonic acid Formula: C13H17NO3S MolecularWeight: 267.34398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C=CN(C2=CC=CC=C12)CCCS(=O)(=O)O

Isomeric SMILES

CC1C=CN(C2=CC=CC=C12)CCCS(=O)(=O)O

InChI

InChI=1S/C13H17NO3S/c1-11-7-9-14(8-4-10-18(15,16)17)13-6-3-2-5-12(11)13/h2-3,5-7,9,11H,4,8,10H2,1H3,(H,15,16,17)