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

Systemtic Name: 2-ethoxy-4-nitro-6-[(2-phenyl-1,3-benzoxazol-5-yl)iminomethyl]phenolate Openeye Name: 2-ethoxy-4-nitro-6-[(2-phenyl-1,3-benzoxazol-5-yl)iminomethyl]phenolate CAS Name: 2-ethoxy-4-nitro-6-[(2-phenyl-1,3-benzoxazol-5-yl)iminomethyl]phenolate IUPAC Name: 2-ethoxy-4-nitro-6-[(2-phenyl-1,3-benzoxazol-5-yl)iminomethyl]phenolate Traditional Name: 2-ethoxy-4-nitro-6-[(2-phenyl-1,3-benzoxazol-5-yl)iminomethyl]phenolate Formula: C22H16N3O5- MolecularWeight: 402.37954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C22H17N3O5/c1-2-29-20-12-17(25(27)28)10-15(21(20)26)13-23-16-8-9-19-18(11-16)24-22(30-19)14-6-4-3-5-7-14/h3-13,26H,2H2,1H3/p-1