(S)-(5-bromanyl-2-fluoranyl-phenyl)-(2-methoxy-5-nitro-phenyl)methanamine

Systemtic Name: (S)-(5-bromanyl-2-fluoranyl-phenyl)-(2-methoxy-5-nitro-phenyl)methanamine Openeye Name: (S)-(5-bromo-2-fluoro-phenyl)-(2-methoxy-5-nitro-phenyl)methanamine CAS Name: (S)-(5-bromo-2-fluorophenyl)-(2-methoxy-5-nitrophenyl)methanamine IUPAC Name: (S)-(5-bromo-2-fluorophenyl)-(2-methoxy-5-nitrophenyl)methanamine Traditional Name: [(S)-(5-bromo-2-fluoro-phenyl)-(2-methoxy-5-nitro-phenyl)methyl]amine Formula: C14H12BrFN2O3 MolecularWeight: 355.159083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(C2=C(C=CC(=C2)Br)F)N

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])[C@@H](C2=C(C=CC(=C2)Br)F)N

InChI

InChI=1S/C14H12BrFN2O3/c1-21-13-5-3-9(18(19)20)7-11(13)14(17)10-6-8(15)2-4-12(10)16/h2-7,14H,17H2,1H3/t14-/m1/s1