5,7-dimethoxy-3-(5-nitrobenzotriazol-1-yl)chromen-2-one

Systemtic Name: 5,7-dimethoxy-3-(5-nitrobenzotriazol-1-yl)chromen-2-one Openeye Name: 5,7-dimethoxy-3-(5-nitrobenzotriazol-1-yl)chromen-2-one CAS Name: 5,7-dimethoxy-3-(5-nitro-1-benzotriazolyl)-1-benzopyran-2-one IUPAC Name: 5,7-dimethoxy-3-(5-nitrobenzotriazol-1-yl)chromen-2-one Traditional Name: 5,7-dimethoxy-3-(5-nitrobenzotriazol-1-yl)coumarin Formula: C17H12N4O6 MolecularWeight: 368.30038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C=C(C(=O)OC2=C1)N3C4=C(C=C(C=C4)[N+](=O)[O-])N=N3)OC

Isomeric SMILES

COC1=CC(=C2C=C(C(=O)OC2=C1)N3C4=C(C=C(C=C4)[N+](=O)[O-])N=N3)OC

InChI

InChI=1S/C17H12N4O6/c1-25-10-6-15(26-2)11-8-14(17(22)27-16(11)7-10)20-13-4-3-9(21(23)24)5-12(13)18-19-20/h3-8H,1-2H3