2-(2-bromanyl-5-nitro-3-phenyl-1-benzofuran-7-yl)ethanoic acid

Systemtic Name: 2-(2-bromanyl-5-nitro-3-phenyl-1-benzofuran-7-yl)ethanoic acid Openeye Name: 2-(2-bromo-5-nitro-3-phenyl-benzofuran-7-yl)acetic acid CAS Name: 2-(2-bromo-5-nitro-3-phenyl-7-benzofuranyl)acetic acid IUPAC Name: 2-(2-bromo-5-nitro-3-phenyl-1-benzofuran-7-yl)acetic acid Traditional Name: 2-(2-bromo-5-nitro-3-phenyl-benzofuran-7-yl)acetic acid Formula: C16H10BrNO5 MolecularWeight: 376.1583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC3=C(C=C(C=C23)[N+](=O)[O-])CC(=O)O)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC3=C(C=C(C=C23)[N+](=O)[O-])CC(=O)O)Br

InChI

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