4-[5-[2-cyano-2-(3-nitrophenyl)ethenyl]furan-2-yl]-3-methyl-benzoic acid

Systemtic Name: 4-[5-[2-cyano-2-(3-nitrophenyl)ethenyl]furan-2-yl]-3-methyl-benzoic acid Openeye Name: 4-[5-[2-cyano-2-(3-nitrophenyl)vinyl]-2-furyl]-3-methyl-benzoic acid CAS Name: 4-[5-[2-cyano-2-(3-nitrophenyl)ethenyl]-2-furanyl]-3-methylbenzoic acid IUPAC Name: 4-[5-[2-cyano-2-(3-nitrophenyl)ethenyl]furan-2-yl]-3-methylbenzoic acid Traditional Name: 4-[5-[2-cyano-2-(3-nitrophenyl)vinyl]-2-furyl]-3-methyl-benzoic acid Formula: C21H14N2O5 MolecularWeight: 374.34626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14N2O5/c1-13-9-15(21(24)25)5-7-19(13)20-8-6-18(28-20)11-16(12-22)14-3-2-4-17(10-14)23(26)27/h2-11H,1H3,(H,24,25)