3-(6-bromanyl-3,4-dihydro-2H-quinolin-1-yl)propane-1-sulfonic acid

Systemtic Name: 3-(6-bromanyl-3,4-dihydro-2H-quinolin-1-yl)propane-1-sulfonic acid Openeye Name: 3-(6-bromo-3,4-dihydro-2H-quinolin-1-yl)propane-1-sulfonic acid CAS Name: 3-(6-bromo-3,4-dihydro-2H-quinolin-1-yl)-1-propanesulfonic acid IUPAC Name: 3-(6-bromo-3,4-dihydro-2H-quinolin-1-yl)propane-1-sulfonic acid Traditional Name: 3-(6-bromo-3,4-dihydro-2H-quinolin-1-yl)propane-1-sulfonic acid Formula: C12H16BrNO3S MolecularWeight: 334.22934

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)Br)N(C1)CCCS(=O)(=O)O

Isomeric SMILES

C1CC2=C(C=CC(=C2)Br)N(C1)CCCS(=O)(=O)O

InChI

InChI=1S/C12H16BrNO3S/c13-11-4-5-12-10(9-11)3-1-6-14(12)7-2-8-18(15,16)17/h4-5,9H,1-3,6-8H2,(H,15,16,17)