3-[[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]carbonylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[[5-(4-methoxy-2-nitro-phenyl)furan-2-yl]carbonylamino]-4-methyl-benzoic acid Openeye Name: 3-[[5-(4-methoxy-2-nitro-phenyl)furan-2-carbonyl]amino]-4-methyl-benzoic acid CAS Name: 3-[[[5-(4-methoxy-2-nitrophenyl)-2-furanyl]-oxomethyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[[5-(4-methoxy-2-nitrophenyl)furan-2-carbonyl]amino]-4-methylbenzoic acid Traditional Name: 3-[[5-(4-methoxy-2-nitro-phenyl)-2-furoyl]amino]-4-methyl-benzoic acid Formula: C20H16N2O7 MolecularWeight: 396.35024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16N2O7/c1-11-3-4-12(20(24)25)9-15(11)21-19(23)18-8-7-17(29-18)14-6-5-13(28-2)10-16(14)22(26)27/h3-10H,1-2H3,(H,21,23)(H,24,25)