butyl 4-[5-[2-[5-cyano-4-(methoxymethyl)-3-nitro-6-oxidanylidene-1H-pyridin-2-yl]ethenyl]furan-2-yl]benzoate

Systemtic Name: butyl 4-[5-[2-[5-cyano-4-(methoxymethyl)-3-nitro-6-oxidanylidene-1H-pyridin-2-yl]ethenyl]furan-2-yl]benzoate Openeye Name: butyl 4-[5-[2-[5-cyano-4-(methoxymethyl)-3-nitro-6-oxo-1H-pyridin-2-yl]vinyl]-2-furyl]benzoate CAS Name: 4-[5-[2-[5-cyano-4-(methoxymethyl)-3-nitro-6-oxo-1H-pyridin-2-yl]ethenyl]-2-furanyl]benzoic acid butyl ester IUPAC Name: butyl 4-[5-[2-[5-cyano-4-(methoxymethyl)-3-nitro-6-oxo-1H-pyridin-2-yl]ethenyl]furan-2-yl]benzoate Traditional Name: 4-[5-[2-[5-cyano-6-keto-4-(methoxymethyl)-3-nitro-1H-pyridin-2-yl]vinyl]-2-furyl]benzoic acid butyl ester Formula: C25H23N3O7 MolecularWeight: 477.46602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=CC3=C(C(=C(C(=O)N3)C#N)COC)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=CC3=C(C(=C(C(=O)N3)C#N)COC)[N+](=O)[O-]

InChI

InChI=1S/C25H23N3O7/c1-3-4-13-34-25(30)17-7-5-16(6-8-17)22-12-10-18(35-22)9-11-21-23(28(31)32)20(15-33-2)19(14-26)24(29)27-21/h5-12H,3-4,13,15H2,1-2H3,(H,27,29)