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

Systemtic Name: 2-[3-(4-bromophenyl)-2-nitro-1-benzofuran-5-yl]ethanoic acid Openeye Name: 2-[3-(4-bromophenyl)-2-nitro-benzofuran-5-yl]acetic acid CAS Name: 2-[3-(4-bromophenyl)-2-nitro-5-benzofuranyl]acetic acid IUPAC Name: 2-[3-(4-bromophenyl)-2-nitro-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[3-(4-bromophenyl)-2-nitro-benzofuran-5-yl]acetic acid Formula: C16H10BrNO5 MolecularWeight: 376.1583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(OC3=C2C=C(C=C3)CC(=O)O)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C2=C(OC3=C2C=C(C=C3)CC(=O)O)[N+](=O)[O-])Br

InChI

InChI=1S/C16H10BrNO5/c17-11-4-2-10(3-5-11)15-12-7-9(8-14(19)20)1-6-13(12)23-16(15)18(21)22/h1-7H,8H2,(H,19,20)