3-[(1-methoxy-3-phenyl-propan-2-yl)amino]propane-1-sulfonic acid

Systemtic Name: 3-[(1-methoxy-3-phenyl-propan-2-yl)amino]propane-1-sulfonic acid Openeye Name: 3-[(1-benzyl-2-methoxy-ethyl)amino]propane-1-sulfonic acid CAS Name: 3-[(1-methoxy-3-phenylpropan-2-yl)amino]-1-propanesulfonic acid IUPAC Name: 3-[(1-methoxy-3-phenylpropan-2-yl)amino]propane-1-sulfonic acid Traditional Name: 3-[(1-benzyl-2-methoxy-ethyl)amino]propane-1-sulfonic acid Formula: C13H21NO4S MolecularWeight: 287.37514

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Descriptors Computed from Structure

Canonical SMILES:

COCC(CC1=CC=CC=C1)NCCCS(=O)(=O)O

Isomeric SMILES

COCC(CC1=CC=CC=C1)NCCCS(=O)(=O)O

InChI

InChI=1S/C13H21NO4S/c1-18-11-13(10-12-6-3-2-4-7-12)14-8-5-9-19(15,16)17/h2-4,6-7,13-14H,5,8-11H2,1H3,(H,15,16,17)