(S)-(6-nitro-1,3-benzodioxol-5-yl)-(5-phenyl-1,3,4-oxadiazol-2-yl)methanol

Systemtic Name: (S)-(6-nitro-1,3-benzodioxol-5-yl)-(5-phenyl-1,3,4-oxadiazol-2-yl)methanol Openeye Name: (S)-(6-nitro-1,3-benzodioxol-5-yl)-(5-phenyl-1,3,4-oxadiazol-2-yl)methanol CAS Name: (S)-(6-nitro-1,3-benzodioxol-5-yl)-(5-phenyl-1,3,4-oxadiazol-2-yl)methanol IUPAC Name: (S)-(6-nitro-1,3-benzodioxol-5-yl)-(5-phenyl-1,3,4-oxadiazol-2-yl)methanol Traditional Name: (S)-(6-nitro-1,3-benzodioxol-5-yl)-(5-phenyl-1,3,4-oxadiazol-2-yl)methanol Formula: C16H11N3O6 MolecularWeight: 341.27504

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C(C3=NN=C(O3)C4=CC=CC=C4)O)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)[C@@H](C3=NN=C(O3)C4=CC=CC=C4)O)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O6/c20-14(16-18-17-15(25-16)9-4-2-1-3-5-9)10-6-12-13(24-8-23-12)7-11(10)19(21)22/h1-7,14,20H,8H2/t14-/m0/s1