propan-2-yl (1R,3S)-3-azido-1-(4-tert-butylphenyl)butane-1-sulfonate

Systemtic Name: propan-2-yl (1R,3S)-3-azido-1-(4-tert-butylphenyl)butane-1-sulfonate Openeye Name: isopropyl (1R,3S)-3-azido-1-(4-tert-butylphenyl)butane-1-sulfonate CAS Name: (1R,3S)-3-azido-1-(4-tert-butylphenyl)-1-butanesulfonic acid IUPAC Name: propan-2-yl (1R,3S)-3-azido-1-(4-tert-butylphenyl)butane-1-sulfonate Traditional Name: (1R,3S)-3-azido-1-(4-tert-butylphenyl)butane-1-sulfonic acid isopropyl ester Formula: C17H27N3O3S MolecularWeight: 353.47958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O3S/c1-12(2)23-24(21,22)16(11-13(3)19-20-18)14-7-9-15(10-8-14)17(4,5)6/h7-10,12-13,16H,11H2,1-6H3/t13-,16+/m0/s1