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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)N=CC4=CC(=CC(=C4[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)N=CC4=CC(=CC(=C4[O-])C)[N+](=O)[O-]

InChI

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