propan-2-yl (1R,3S)-3-azido-1-phenyl-butane-1-sulfonate

Systemtic Name: propan-2-yl (1R,3S)-3-azido-1-phenyl-butane-1-sulfonate Openeye Name: isopropyl (1R,3S)-3-azido-1-phenyl-butane-1-sulfonate CAS Name: (1R,3S)-3-azido-1-phenyl-1-butanesulfonic acid IUPAC Name: propan-2-yl (1R,3S)-3-azido-1-phenylbutane-1-sulfonate Traditional Name: (1R,3S)-3-azido-1-phenyl-butane-1-sulfonic acid isopropyl ester Formula: C13H19N3O3S MolecularWeight: 297.37326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OS(=O)(=O)C(CC(C)N=[N+]=[N-])C1=CC=CC=C1

Isomeric SMILES

C[C@@H](C[C@H](C1=CC=CC=C1)S(=O)(=O)OC(C)C)N=[N+]=[N-]

InChI

InChI=1S/C13H19N3O3S/c1-10(2)19-20(17,18)13(9-11(3)15-16-14)12-7-5-4-6-8-12/h4-8,10-11,13H,9H2,1-3H3/t11-,13+/m0/s1