2,3,4,5-tetrakis(bromanyl)-6-[(2-methoxy-3-nitro-phenyl)carbamoyl]benzoic acid

Systemtic Name: 2,3,4,5-tetrakis(bromanyl)-6-[(2-methoxy-3-nitro-phenyl)carbamoyl]benzoic acid Openeye Name: 2,3,4,5-tetrabromo-6-[(2-methoxy-3-nitro-phenyl)carbamoyl]benzoic acid CAS Name: 2,3,4,5-tetrabromo-6-[(2-methoxy-3-nitroanilino)-oxomethyl]benzoic acid IUPAC Name: 2,3,4,5-tetrabromo-6-[(2-methoxy-3-nitrophenyl)carbamoyl]benzoic acid Traditional Name: 2,3,4,5-tetrabromo-6-[(2-methoxy-3-nitro-phenyl)carbamoyl]benzoic acid Formula: C15H8Br4N2O6 MolecularWeight: 631.84982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=C(C(=C(C(=C2Br)Br)Br)Br)C(=O)O

Isomeric SMILES

COC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=C(C(=C(C(=C2Br)Br)Br)Br)C(=O)O

InChI

InChI=1S/C15H8Br4N2O6/c1-27-13-5(3-2-4-6(13)21(25)26)20-14(22)7-8(15(23)24)10(17)12(19)11(18)9(7)16/h2-4H,1H3,(H,20,22)(H,23,24)