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

Systemtic Name: 2-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[5-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]iminomethyl]-4-nitro-phenolate Formula: C21H14N3O4- MolecularWeight: 372.35356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15N3O4/c1-13-6-7-14(21-23-17-4-2-3-5-20(17)28-21)11-18(13)22-12-15-10-16(24(26)27)8-9-19(15)25/h2-12,25H,1H3/p-1