2-[2-[3-(4-chlorophenyl)-2-nitro-1-benzofuran-5-yl]phenyl]ethanoic acid

Systemtic Name: 2-[2-[3-(4-chlorophenyl)-2-nitro-1-benzofuran-5-yl]phenyl]ethanoic acid Openeye Name: 2-[2-[3-(4-chlorophenyl)-2-nitro-benzofuran-5-yl]phenyl]acetic acid CAS Name: 2-[2-[3-(4-chlorophenyl)-2-nitro-5-benzofuranyl]phenyl]acetic acid IUPAC Name: 2-[2-[3-(4-chlorophenyl)-2-nitro-1-benzofuran-5-yl]phenyl]acetic acid Traditional Name: 2-[2-[3-(4-chlorophenyl)-2-nitro-benzofuran-5-yl]phenyl]acetic acid Formula: C22H14ClNO5 MolecularWeight: 407.80326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)O)C2=CC3=C(C=C2)OC(=C3C4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)O)C2=CC3=C(C=C2)OC(=C3C4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H14ClNO5/c23-16-8-5-13(6-9-16)21-18-11-15(7-10-19(18)29-22(21)24(27)28)17-4-2-1-3-14(17)12-20(25)26/h1-11H,12H2,(H,25,26)