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

Systemtic Name: 2-[3-(3-methoxyphenyl)-2-nitro-1-benzofuran-5-yl]ethanoic acid Openeye Name: 2-[3-(3-methoxyphenyl)-2-nitro-benzofuran-5-yl]acetic acid CAS Name: 2-[3-(3-methoxyphenyl)-2-nitro-5-benzofuranyl]acetic acid IUPAC Name: 2-[3-(3-methoxyphenyl)-2-nitro-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[3-(3-methoxyphenyl)-2-nitro-benzofuran-5-yl]acetic acid Formula: C17H13NO6 MolecularWeight: 327.28822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(OC3=C2C=C(C=C3)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(OC3=C2C=C(C=C3)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H13NO6/c1-23-12-4-2-3-11(9-12)16-13-7-10(8-15(19)20)5-6-14(13)24-17(16)18(21)22/h2-7,9H,8H2,1H3,(H,19,20)