4-chloranyl-2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-6-nitrophenolate Traditional Name: 4-chloro-2-[[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-6-nitro-phenolate Formula: C23H17ClN3O4- MolecularWeight: 434.85178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CC=C3)N=CC4=CC(=CC(=C4[O-])[N+](=O)[O-])Cl)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CC=C3)N=CC4=CC(=CC(=C4[O-])[N+](=O)[O-])Cl)C)C

InChI

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