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

Systemtic Name: 2-[[2-methyl-4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitro-phenolate Openeye Name: 2-[[2-methyl-4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitro-phenolate CAS Name: 2-[[2-methyl-4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitrophenolate IUPAC Name: 2-[[2-methyl-4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitrophenolate Traditional Name: 2-[[2-methyl-4-(5-methyl-1,3-benzoxazol-2-yl)phenyl]iminomethyl]-6-nitro-phenolate Formula: C22H16N3O4- MolecularWeight: 386.38014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)N=CC4=C(C(=CC=C4)[N+](=O)[O-])[O-])C

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)N=CC4=C(C(=CC=C4)[N+](=O)[O-])[O-])C

InChI

InChI=1S/C22H17N3O4/c1-13-6-9-20-18(10-13)24-22(29-20)15-7-8-17(14(2)11-15)23-12-16-4-3-5-19(21(16)26)25(27)28/h3-12,26H,1-2H3/p-1