3-[5,6-bis(bromanyl)-3,4-dihydro-2H-quinolin-1-yl]propane-1-sulfonic acid

Systemtic Name: 3-[5,6-bis(bromanyl)-3,4-dihydro-2H-quinolin-1-yl]propane-1-sulfonic acid Openeye Name: 3-(5,6-dibromo-3,4-dihydro-2H-quinolin-1-yl)propane-1-sulfonic acid CAS Name: 3-(5,6-dibromo-3,4-dihydro-2H-quinolin-1-yl)-1-propanesulfonic acid IUPAC Name: 3-(5,6-dibromo-3,4-dihydro-2H-quinolin-1-yl)propane-1-sulfonic acid Traditional Name: 3-(5,6-dibromo-3,4-dihydro-2H-quinolin-1-yl)propane-1-sulfonic acid Formula: C12H15Br2NO3S MolecularWeight: 413.1254

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2Br)Br)N(C1)CCCS(=O)(=O)O

Isomeric SMILES

C1CC2=C(C=CC(=C2Br)Br)N(C1)CCCS(=O)(=O)O

InChI

InChI=1S/C12H15Br2NO3S/c13-10-4-5-11-9(12(10)14)3-1-6-15(11)7-2-8-19(16,17)18/h4-5H,1-3,6-8H2,(H,16,17,18)