2-[4-(4-azanyl-3-nitro-phenoxy)-3,5-bis(bromanyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(4-azanyl-3-nitro-phenoxy)-3,5-bis(bromanyl)phenyl]ethanoic acid Openeye Name: 2-[4-(4-amino-3-nitro-phenoxy)-3,5-dibromo-phenyl]acetic acid CAS Name: 2-[4-(4-amino-3-nitrophenoxy)-3,5-dibromophenyl]acetic acid IUPAC Name: 2-[4-(4-amino-3-nitrophenoxy)-3,5-dibromophenyl]acetic acid Traditional Name: 2-[4-(4-amino-3-nitro-phenoxy)-3,5-dibromo-phenyl]acetic acid Formula: C14H10Br2N2O5 MolecularWeight: 446.0476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC2=C(C=C(C=C2Br)CC(=O)O)Br)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=C(C=C1OC2=C(C=C(C=C2Br)CC(=O)O)Br)[N+](=O)[O-])N

InChI

InChI=1S/C14H10Br2N2O5/c15-9-3-7(5-13(19)20)4-10(16)14(9)23-8-1-2-11(17)12(6-8)18(21)22/h1-4,6H,5,17H2,(H,19,20)