4-chloranyl-3,5-dimethyl-2-[[3-(4-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-3,5-dimethyl-2-[[3-(4-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitro-phenolate Openeye Name: 4-chloro-3,5-dimethyl-2-[[3-(4-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitro-phenolate CAS Name: 4-chloro-3,5-dimethyl-2-[[3-(4-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitrophenolate IUPAC Name: 4-chloro-3,5-dimethyl-2-[[3-(4-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitrophenolate Traditional Name: 4-chloro-3,5-dimethyl-2-[[3-(4-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitro-phenolate Formula: C23H17ClN3O4- MolecularWeight: 434.85178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)OC(=N2)C3=CC(=CC=C3)N=CC4=C(C(=C(C(=C4[O-])[N+](=O)[O-])C)Cl)C

Isomeric SMILES

CC1=C2C(=CC=C1)OC(=N2)C3=CC(=CC=C3)N=CC4=C(C(=C(C(=C4[O-])[N+](=O)[O-])C)Cl)C

InChI

InChI=1S/C23H18ClN3O4/c1-12-6-4-9-18-20(12)26-23(31-18)15-7-5-8-16(10-15)25-11-17-13(2)19(24)14(3)21(22(17)28)27(29)30/h4-11,28H,1-3H3/p-1