2-bromanyl-5-nitro-4-(2-oxidanylhexylamino)phenol

Systemtic Name: 2-bromanyl-5-nitro-4-(2-oxidanylhexylamino)phenol Openeye Name: 2-bromo-4-(2-hydroxyhexylamino)-5-nitro-phenol CAS Name: 2-bromo-4-(2-hydroxyhexylamino)-5-nitrophenol IUPAC Name: 2-bromo-4-(2-hydroxyhexylamino)-5-nitrophenol Traditional Name: 2-bromo-4-(2-hydroxyhexylamino)-5-nitro-phenol Formula: C12H17BrN2O4 MolecularWeight: 333.17838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CNC1=CC(=C(C=C1[N+](=O)[O-])O)Br)O

Isomeric SMILES

CCCCC(CNC1=CC(=C(C=C1[N+](=O)[O-])O)Br)O

InChI

InChI=1S/C12H17BrN2O4/c1-2-3-4-8(16)7-14-10-5-9(13)12(17)6-11(10)15(18)19/h5-6,8,14,16-17H,2-4,7H2,1H3