3-[[(2R)-4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]amino]propane-1-sulfonic acid

Systemtic Name: 3-[[(2R)-4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]amino]propane-1-sulfonic acid Openeye Name: 3-[[(1R)-1-benzyloxycarbonyl-3-methyl-butyl]amino]propane-1-sulfonic acid CAS Name: 3-[[(2R)-4-methyl-1-oxo-1-phenylmethoxypentan-2-yl]amino]-1-propanesulfonic acid IUPAC Name: 3-[[(2R)-4-methyl-1-oxo-1-phenylmethoxypentan-2-yl]amino]propane-1-sulfonic acid Traditional Name: 3-[[(1R)-1-carbobenzoxy-3-methyl-butyl]amino]propane-1-sulfonic acid Formula: C16H25NO5S MolecularWeight: 343.4384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)NCCCS(=O)(=O)O

Isomeric SMILES

CC(C)C[C@H](C(=O)OCC1=CC=CC=C1)NCCCS(=O)(=O)O

InChI

InChI=1S/C16H25NO5S/c1-13(2)11-15(17-9-6-10-23(19,20)21)16(18)22-12-14-7-4-3-5-8-14/h3-5,7-8,13,15,17H,6,9-12H2,1-2H3,(H,19,20,21)/t15-/m1/s1