2-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-4,6-bis(bromanyl)phenolate

Systemtic Name: 2-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-4,6-bis(bromanyl)phenolate Openeye Name: 2-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-4,6-dibromo-phenolate CAS Name: 2-[[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-4,6-dibromophenolate IUPAC Name: 2-[[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-4,6-dibromophenolate Traditional Name: 2-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-4,6-dibromo-phenolate Formula: C21H13Br2N2O2- MolecularWeight: 485.14812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)N=CC4=CC(=CC(=C4[O-])Br)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)N=CC4=CC(=CC(=C4[O-])Br)Br

InChI

InChI=1S/C21H14Br2N2O2/c1-12-6-7-13(21-25-17-4-2-3-5-19(17)27-21)9-18(12)24-11-14-8-15(22)10-16(23)20(14)26/h2-11,26H,1H3/p-1