4-[[5-(4-methyl-2-nitro-phenyl)furan-2-yl]carbonylamino]-2-oxidanyl-benzoate

Systemtic Name: 4-[[5-(4-methyl-2-nitro-phenyl)furan-2-yl]carbonylamino]-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-4-[[5-(4-methyl-2-nitro-phenyl)furan-2-carbonyl]amino]benzoate CAS Name: 2-hydroxy-4-[[[5-(4-methyl-2-nitrophenyl)-2-furanyl]-oxomethyl]amino]benzoate IUPAC Name: 2-hydroxy-4-[[5-(4-methyl-2-nitrophenyl)furan-2-carbonyl]amino]benzoate Traditional Name: 2-hydroxy-4-[[5-(4-methyl-2-nitro-phenyl)-2-furoyl]amino]benzoate Formula: C19H13N2O7- MolecularWeight: 381.31572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=C(O2)C(=O)NC3=CC(=C(C=C3)C(=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=C(O2)C(=O)NC3=CC(=C(C=C3)C(=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C19H14N2O7/c1-10-2-4-12(14(8-10)21(26)27)16-6-7-17(28-16)18(23)20-11-3-5-13(19(24)25)15(22)9-11/h2-9,22H,1H3,(H,20,23)(H,24,25)/p-1