2-fluoranyl-3-(1-phenylpropan-2-ylamino)propane-1-sulfonic acid

Systemtic Name: 2-fluoranyl-3-(1-phenylpropan-2-ylamino)propane-1-sulfonic acid Openeye Name: 2-fluoro-3-[(1-methyl-2-phenyl-ethyl)amino]propane-1-sulfonic acid CAS Name: 2-fluoro-3-(1-phenylpropan-2-ylamino)-1-propanesulfonic acid IUPAC Name: 2-fluoro-3-(1-phenylpropan-2-ylamino)propane-1-sulfonic acid Traditional Name: 2-fluoro-3-[(1-methyl-2-phenyl-ethyl)amino]propane-1-sulfonic acid Formula: C12H18FNO3S MolecularWeight: 275.339623

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)NCC(CS(=O)(=O)O)F

Isomeric SMILES

CC(CC1=CC=CC=C1)NCC(CS(=O)(=O)O)F

InChI

InChI=1S/C12H18FNO3S/c1-10(7-11-5-3-2-4-6-11)14-8-12(13)9-18(15,16)17/h2-6,10,12,14H,7-9H2,1H3,(H,15,16,17)