2-[2-nitro-4-[oxidanyl(phenyl)methyl]phenyl]propanoic acid

Systemtic Name: 2-[2-nitro-4-[oxidanyl(phenyl)methyl]phenyl]propanoic acid Openeye Name: 2-[4-[hydroxy(phenyl)methyl]-2-nitro-phenyl]propanoic acid CAS Name: 2-[4-[hydroxy(phenyl)methyl]-2-nitrophenyl]propanoic acid IUPAC Name: 2-[4-[hydroxy(phenyl)methyl]-2-nitrophenyl]propanoic acid Traditional Name: 2-[4-[hydroxy(phenyl)methyl]-2-nitro-phenyl]propionic acid Formula: C16H15NO5 MolecularWeight: 301.294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO5/c1-10(16(19)20)13-8-7-12(9-14(13)17(21)22)15(18)11-5-3-2-4-6-11/h2-10,15,18H,1H3,(H,19,20)