1-[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitro-naphthalen-2-olate

Systemtic Name: 1-[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitro-naphthalen-2-olate Openeye Name: 1-[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitro-naphthalen-2-olate CAS Name: 1-[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitro-2-naphthalenolate IUPAC Name: 1-[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitronaphthalen-2-olate Traditional Name: 1-[[2-(4-ethylphenyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitro-naphthalen-2-olate Formula: C26H18N3O4- MolecularWeight: 436.43882

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)N=CC4=C(C=CC5=C4C=CC(=C5)[N+](=O)[O-])[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)N=CC4=C(C=CC5=C4C=CC(=C5)[N+](=O)[O-])[O-]

InChI

InChI=1S/C26H19N3O4/c1-2-16-3-5-17(6-4-16)26-28-23-14-19(8-12-25(23)33-26)27-15-22-21-10-9-20(29(31)32)13-18(21)7-11-24(22)30/h3-15,30H,2H2,1H3/p-1