2-(5-tert-butyl-1,3-dithian-2-yl)-4-nitro-phenol

Systemtic Name: 2-(5-tert-butyl-1,3-dithian-2-yl)-4-nitro-phenol Openeye Name: 2-(5-tert-butyl-1,3-dithian-2-yl)-4-nitro-phenol CAS Name: 2-(5-tert-butyl-1,3-dithian-2-yl)-4-nitrophenol IUPAC Name: 2-(5-tert-butyl-1,3-dithian-2-yl)-4-nitrophenol Traditional Name: 2-(5-tert-butyl-1,3-dithian-2-yl)-4-nitro-phenol Formula: C14H19NO3S2 MolecularWeight: 313.43556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CSC(SC1)C2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C)(C)C1CSC(SC1)C2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C14H19NO3S2/c1-14(2,3)9-7-19-13(20-8-9)11-6-10(15(17)18)4-5-12(11)16/h4-6,9,13,16H,7-8H2,1-3H3