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

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

Systemtic Name:2-[4-(3-methyl-2-nitro-1-benzofuran-5-yl)phenyl]ethanoic acid
Openeye Name:2-[4-(3-methyl-2-nitro-benzofuran-5-yl)phenyl]acetic acid
CAS Name:2-[4-(3-methyl-2-nitro-5-benzofuranyl)phenyl]acetic acid
IUPAC Name:2-[4-(3-methyl-2-nitro-1-benzofuran-5-yl)phenyl]acetic acid
Traditional Name:2-[4-(3-methyl-2-nitro-benzofuran-5-yl)phenyl]acetic acid
Formula: C17H13NO5
MolecularWeight: 311.28882
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)C3=CC=C(C=C3)CC(=O)O)[N+](=O)[O-]


Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)C3=CC=C(C=C3)CC(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C17H13NO5/c1-10-14-9-13(6-7-15(14)23-17(10)18(21)22)12-4-2-11(3-5-12)8-16(19)20/h2-7,9H,8H2,1H3,(H,19,20)


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