4-[(Z)-2-chloranyl-2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethenyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(Z)-2-chloranyl-2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethenyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(Z)-2-chloro-2-(5-phenyl-1,3,4-oxadiazol-2-yl)vinyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(Z)-2-chloro-2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethenyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(Z)-2-chloro-2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethenyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(Z)-2-chloro-2-(5-phenyl-1,3,4-oxadiazol-2-yl)vinyl]-2-methoxy-6-nitro-phenolate Formula: C17H11ClN3O5- MolecularWeight: 372.73934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C(C2=NN=C(O2)C3=CC=CC=C3)Cl

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C(/C2=NN=C(O2)C3=CC=CC=C3)\Cl

InChI

InChI=1S/C17H12ClN3O5/c1-25-14-9-10(8-13(15(14)22)21(23)24)7-12(18)17-20-19-16(26-17)11-5-3-2-4-6-11/h2-9,22H,1H3/p-1/b12-7-