(2S)-2-azanyl-3-[3-(trifluoromethyl)phenyl]propane-1-sulfonic acid

Systemtic Name: (2S)-2-azanyl-3-[3-(trifluoromethyl)phenyl]propane-1-sulfonic acid Openeye Name: (2S)-2-amino-3-[3-(trifluoromethyl)phenyl]propane-1-sulfonic acid CAS Name: (2S)-2-amino-3-[3-(trifluoromethyl)phenyl]-1-propanesulfonic acid IUPAC Name: (2S)-2-amino-3-[3-(trifluoromethyl)phenyl]propane-1-sulfonic acid Traditional Name: (2S)-2-amino-3-[3-(trifluoromethyl)phenyl]propane-1-sulfonic acid Formula: C10H12F3NO3S MolecularWeight: 283.26739

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CC(CS(=O)(=O)O)N

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C[C@@H](CS(=O)(=O)O)N

InChI

InChI=1S/C10H12F3NO3S/c11-10(12,13)8-3-1-2-7(4-8)5-9(14)6-18(15,16)17/h1-4,9H,5-6,14H2,(H,15,16,17)/t9-/m0/s1