[4-[2-[4-[(4-methyl-3-nitro-phenyl)amino]-4-oxidanylidene-butanoyl]oxyethanoyl]phenyl] furan-2-carboxylate

Systemtic Name: [4-[2-[4-[(4-methyl-3-nitro-phenyl)amino]-4-oxidanylidene-butanoyl]oxyethanoyl]phenyl] furan-2-carboxylate Openeye Name: [4-[2-[4-(4-methyl-3-nitro-anilino)-4-oxo-butanoyl]oxyacetyl]phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[2-[4-(4-methyl-3-nitroanilino)-1,4-dioxobutoxy]-1-oxoethyl]phenyl] ester IUPAC Name: [4-[2-[4-(4-methyl-3-nitroanilino)-4-oxobutanoyl]oxyacetyl]phenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[2-[4-keto-4-(4-methyl-3-nitro-anilino)butanoyl]oxyacetyl]phenyl] ester Formula: C24H20N2O9 MolecularWeight: 480.4236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC(=O)OCC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC(=O)OCC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C24H20N2O9/c1-15-4-7-17(13-19(15)26(31)32)25-22(28)10-11-23(29)34-14-20(27)16-5-8-18(9-6-16)35-24(30)21-3-2-12-33-21/h2-9,12-13H,10-11,14H2,1H3,(H,25,28)