4-azido-5-oxidanyl-3-(phenylcarbonyloxy)-6-phenylsulfanyl-oxane-2-carboxylic acid

Systemtic Name: 4-azido-5-oxidanyl-3-(phenylcarbonyloxy)-6-phenylsulfanyl-oxane-2-carboxylic acid Openeye Name: 4-azido-3-benzoyloxy-5-hydroxy-6-phenylsulfanyl-tetrahydropyran-2-carboxylic acid CAS Name: 4-azido-3-benzoyloxy-5-hydroxy-6-(phenylthio)-2-oxanecarboxylic acid IUPAC Name: 4-azido-3-benzoyloxy-5-hydroxy-6-phenylsulfanyloxane-2-carboxylic acid Traditional Name: 4-azido-3-benzoyloxy-5-hydroxy-6-(phenylthio)tetrahydropyran-2-carboxylic acid Formula: C19H17N3O6S MolecularWeight: 415.41978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2C(C(C(OC2C(=O)O)SC3=CC=CC=C3)O)N=[N+]=[N-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2C(C(C(OC2C(=O)O)SC3=CC=CC=C3)O)N=[N+]=[N-]

InChI

InChI=1S/C19H17N3O6S/c20-22-21-13-14(23)19(29-12-9-5-2-6-10-12)28-16(17(24)25)15(13)27-18(26)11-7-3-1-4-8-11/h1-10,13-16,19,23H,(H,24,25)