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

Systemtic Name: 2-[[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-6-ethoxy-4-nitro-phenolate Openeye Name: 2-[[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-6-ethoxy-4-nitro-phenolate CAS Name: 2-[[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-6-ethoxy-4-nitrophenolate IUPAC Name: 2-[[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-6-ethoxy-4-nitrophenolate Traditional Name: 2-[[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-6-ethoxy-4-nitro-phenolate Formula: C25H22N3O5- MolecularWeight: 444.45928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=C(C=CC(=C2)C3=NC4=CC(=CC(=C4O3)C)C)C)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=C(C=CC(=C2)C3=NC4=CC(=CC(=C4O3)C)C)C)[O-]

InChI

InChI=1S/C25H23N3O5/c1-5-32-22-12-19(28(30)31)10-18(23(22)29)13-26-20-11-17(7-6-15(20)3)25-27-21-9-14(2)8-16(4)24(21)33-25/h6-13,29H,5H2,1-4H3/p-1