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

Systemtic Name: 2-bromanyl-5-(5-tert-butyl-1,3-dithian-2-yl)-4-nitro-phenol Openeye Name: 2-bromo-5-(5-tert-butyl-1,3-dithian-2-yl)-4-nitro-phenol CAS Name: 2-bromo-5-(5-tert-butyl-1,3-dithian-2-yl)-4-nitrophenol IUPAC Name: 2-bromo-5-(5-tert-butyl-1,3-dithian-2-yl)-4-nitrophenol Traditional Name: 2-bromo-5-(5-tert-butyl-1,3-dithian-2-yl)-4-nitro-phenol Formula: C14H18BrNO3S2 MolecularWeight: 392.33162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrNO3S2/c1-14(2,3)8-6-20-13(21-7-8)9-4-12(17)10(15)5-11(9)16(18)19/h4-5,8,13,17H,6-7H2,1-3H3