4-methyl-3-[5-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]furan-2-yl]benzoic acid

Systemtic Name: 4-methyl-3-[5-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]furan-2-yl]benzoic acid Openeye Name: 4-methyl-3-[5-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]-2-furyl]benzoic acid CAS Name: 4-methyl-3-[5-[(E)-2-(3-methyl-4-nitro-5-isoxazolyl)ethenyl]-2-furanyl]benzoic acid IUPAC Name: 4-methyl-3-[5-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]furan-2-yl]benzoic acid Traditional Name: 4-methyl-3-[5-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]-2-furyl]benzoic acid Formula: C18H14N2O6 MolecularWeight: 354.31356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)C2=CC=C(O2)C=CC3=C(C(=NO3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)C2=CC=C(O2)/C=C/C3=C(C(=NO3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O6/c1-10-3-4-12(18(21)22)9-14(10)15-7-5-13(25-15)6-8-16-17(20(23)24)11(2)19-26-16/h3-9H,1-2H3,(H,21,22)/b8-6+