[(7R,9R,10S)-7-acetyloxy-9-azido-1,4-dithiaspiro[4.5]decan-10-yl] benzoate

Systemtic Name: [(7R,9R,10S)-7-acetyloxy-9-azido-1,4-dithiaspiro[4.5]decan-10-yl] benzoate Openeye Name: [(7R,9R,10S)-7-acetoxy-9-azido-1,4-dithiaspiro[4.5]decan-10-yl] benzoate CAS Name: benzoic acid [(7R,9R,10S)-7-acetyloxy-9-azido-1,4-dithiaspiro[4.5]decan-10-yl] ester IUPAC Name: [(7R,9R,10S)-7-acetyloxy-9-azido-1,4-dithiaspiro[4.5]decan-10-yl] benzoate Traditional Name: benzoic acid [(7R,9R,10S)-7-acetoxy-9-azido-1,4-dithiaspiro[4.5]decan-10-yl] ester Formula: C17H19N3O4S2 MolecularWeight: 393.48046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(C(C2(C1)SCCS2)OC(=O)C3=CC=CC=C3)N=[N+]=[N-]

Isomeric SMILES

CC(=O)O[C@@H]1C[C@H]([C@@H](C2(C1)SCCS2)OC(=O)C3=CC=CC=C3)N=[N+]=[N-]

InChI

InChI=1S/C17H19N3O4S2/c1-11(21)23-13-9-14(19-20-18)15(17(10-13)25-7-8-26-17)24-16(22)12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13-,14-,15+/m1/s1