6-azido-3,5-bis(oxidanyl)-4-phenylmethoxy-oxepan-2-one

Systemtic Name: 6-azido-3,5-bis(oxidanyl)-4-phenylmethoxy-oxepan-2-one Openeye Name: 6-azido-4-benzyloxy-3,5-dihydroxy-oxepan-2-one CAS Name: 6-azido-3,5-dihydroxy-4-phenylmethoxy-2-oxepanone IUPAC Name: 6-azido-3,5-dihydroxy-4-phenylmethoxyoxepan-2-one Traditional Name: 6-azido-4-benzoxy-3,5-dihydroxy-oxepan-2-one Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(C(=O)O1)O)OCC2=CC=CC=C2)O)N=[N+]=[N-]

Isomeric SMILES

C1C(C(C(C(C(=O)O1)O)OCC2=CC=CC=C2)O)N=[N+]=[N-]

InChI

InChI=1S/C13H15N3O5/c14-16-15-9-7-21-13(19)11(18)12(10(9)17)20-6-8-4-2-1-3-5-8/h1-5,9-12,17-18H,6-7H2