3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propane-1-sulfonic acid

Systemtic Name: 3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propane-1-sulfonic acid Openeye Name: 3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propane-1-sulfonic acid CAS Name: 3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]-1-propanesulfonic acid IUPAC Name: 3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propane-1-sulfonic acid Traditional Name: 3-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propane-1-sulfonic acid Formula: C12H19NO4S MolecularWeight: 273.34856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OC)NCCCS(=O)(=O)O

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)OC)NCCCS(=O)(=O)O

InChI

InChI=1S/C12H19NO4S/c1-10(13-8-3-9-18(14,15)16)11-4-6-12(17-2)7-5-11/h4-7,10,13H,3,8-9H2,1-2H3,(H,14,15,16)/t10-/m0/s1