2-(5-nitro-2-thiophen-2-yl-1,3-dioxan-4-yl)phenol

Systemtic Name: 2-(5-nitro-2-thiophen-2-yl-1,3-dioxan-4-yl)phenol Openeye Name: 2-[5-nitro-2-(2-thienyl)-1,3-dioxan-4-yl]phenol CAS Name: 2-(5-nitro-2-thiophen-2-yl-1,3-dioxan-4-yl)phenol IUPAC Name: 2-(5-nitro-2-thiophen-2-yl-1,3-dioxan-4-yl)phenol Traditional Name: 2-[5-nitro-2-(2-thienyl)-1,3-dioxan-4-yl]phenol Formula: C14H13NO5S MolecularWeight: 307.32172

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC(O1)C2=CC=CS2)C3=CC=CC=C3O)[N+](=O)[O-]

Isomeric SMILES

C1C(C(OC(O1)C2=CC=CS2)C3=CC=CC=C3O)[N+](=O)[O-]

InChI

InChI=1S/C14H13NO5S/c16-11-5-2-1-4-9(11)13-10(15(17)18)8-19-14(20-13)12-6-3-7-21-12/h1-7,10,13-14,16H,8H2