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

Systemtic Name: 2-[5-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]furan-2-yl]benzoic acid Openeye Name: 2-[5-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]-2-furyl]benzoic acid CAS Name: 2-[5-[(E)-2-(3-methyl-4-nitro-5-isoxazolyl)ethenyl]-2-furanyl]benzoic acid IUPAC Name: 2-[5-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]furan-2-yl]benzoic acid Traditional Name: 2-[5-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]-2-furyl]benzoic acid Formula: C17H12N2O6 MolecularWeight: 340.28698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])C=CC2=CC=C(O2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=NOC(=C1[N+](=O)[O-])/C=C/C2=CC=C(O2)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C17H12N2O6/c1-10-16(19(22)23)15(25-18-10)9-7-11-6-8-14(24-11)12-4-2-3-5-13(12)17(20)21/h2-9H,1H3,(H,20,21)/b9-7+