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

Systemtic Name: 1-[[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitro-naphthalen-2-olate Openeye Name: 6-nitro-1-[[2-(o-tolyl)-1,3-benzoxazol-5-yl]iminomethyl]naphthalen-2-olate CAS Name: 1-[[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitro-2-naphthalenolate IUPAC Name: 1-[[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-nitronaphthalen-2-olate Traditional Name: 6-nitro-1-[[2-(o-tolyl)-1,3-benzoxazol-5-yl]iminomethyl]naphthalen-2-olate Formula: C25H16N3O4- MolecularWeight: 422.41224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(O2)C=CC(=C3)N=CC4=C(C=CC5=C4C=CC(=C5)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(O2)C=CC(=C3)N=CC4=C(C=CC5=C4C=CC(=C5)[N+](=O)[O-])[O-]

InChI

InChI=1S/C25H17N3O4/c1-15-4-2-3-5-19(15)25-27-22-13-17(7-11-24(22)32-25)26-14-21-20-9-8-18(28(30)31)12-16(20)6-10-23(21)29/h2-14,29H,1H3/p-1