(S)-(2-bromanyl-5-fluoranyl-phenyl)-(3,4-dimethyl-5-nitro-phenyl)methanamine

Systemtic Name: (S)-(2-bromanyl-5-fluoranyl-phenyl)-(3,4-dimethyl-5-nitro-phenyl)methanamine Openeye Name: (S)-(2-bromo-5-fluoro-phenyl)-(3,4-dimethyl-5-nitro-phenyl)methanamine CAS Name: (S)-(2-bromo-5-fluorophenyl)-(3,4-dimethyl-5-nitrophenyl)methanamine IUPAC Name: (S)-(2-bromo-5-fluorophenyl)-(3,4-dimethyl-5-nitrophenyl)methanamine Traditional Name: [(S)-(2-bromo-5-fluoro-phenyl)-(3,4-dimethyl-5-nitro-phenyl)methyl]amine Formula: C15H14BrFN2O2 MolecularWeight: 353.186263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C2=C(C=CC(=C2)F)Br)N)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC(=C1)[C@@H](C2=C(C=CC(=C2)F)Br)N)[N+](=O)[O-])C

InChI

InChI=1S/C15H14BrFN2O2/c1-8-5-10(6-14(9(8)2)19(20)21)15(18)12-7-11(17)3-4-13(12)16/h3-7,15H,18H2,1-2H3/t15-/m0/s1