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

Systemtic Name: 2-[3-(3-chlorophenyl)-2-nitro-1-benzofuran-5-yl]ethanoic acid Openeye Name: 2-[3-(3-chlorophenyl)-2-nitro-benzofuran-5-yl]acetic acid CAS Name: 2-[3-(3-chlorophenyl)-2-nitro-5-benzofuranyl]acetic acid IUPAC Name: 2-[3-(3-chlorophenyl)-2-nitro-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[3-(3-chlorophenyl)-2-nitro-benzofuran-5-yl]acetic acid Formula: C16H10ClNO5 MolecularWeight: 331.7073

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=C(OC3=C2C=C(C=C3)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=C(OC3=C2C=C(C=C3)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H10ClNO5/c17-11-3-1-2-10(8-11)15-12-6-9(7-14(19)20)4-5-13(12)23-16(15)18(21)22/h1-6,8H,7H2,(H,19,20)