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

Systemtic Name: 2-[[2-(5-chloranylnaphthalen-1-yl)-1,3-benzoxazol-5-yl]iminomethyl]-6-ethoxy-4-nitro-phenolate Openeye Name: 2-[[2-(5-chloro-1-naphthyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-ethoxy-4-nitro-phenolate CAS Name: 2-[[2-(5-chloro-1-naphthalenyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-ethoxy-4-nitrophenolate IUPAC Name: 2-[[2-(5-chloronaphthalen-1-yl)-1,3-benzoxazol-5-yl]iminomethyl]-6-ethoxy-4-nitrophenolate Traditional Name: 2-[[2-(5-chloro-1-naphthyl)-1,3-benzoxazol-5-yl]iminomethyl]-6-ethoxy-4-nitro-phenolate Formula: C26H17ClN3O5- MolecularWeight: 486.88328

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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=CC5=C4C=CC=C5Cl)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NC2=CC3=C(C=C2)OC(=N3)C4=CC=CC5=C4C=CC=C5Cl)[O-]

InChI

InChI=1S/C26H18ClN3O5/c1-2-34-24-13-17(30(32)33)11-15(25(24)31)14-28-16-9-10-23-22(12-16)29-26(35-23)20-7-3-6-19-18(20)5-4-8-21(19)27/h3-14,31H,2H2,1H3/p-1