4-chloranyl-2-[[4-chloranyl-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[[4-chloranyl-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitrophenolate Traditional Name: 4-chloro-2-[[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitro-phenolate Formula: C21H12Cl2N3O4- MolecularWeight: 441.24368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)N=CC4=CC(=CC(=C4[O-])[N+](=O)[O-])Cl)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)N=CC4=CC(=CC(=C4[O-])[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C21H13Cl2N3O4/c1-11-2-5-17-19(6-11)30-21(25-17)15-9-14(3-4-16(15)23)24-10-12-7-13(22)8-18(20(12)27)26(28)29/h2-10,27H,1H3/p-1