2-[(5-chloranyl-2-nitro-phenyl)methyl]benzoic acid

Systemtic Name: 2-[(5-chloranyl-2-nitro-phenyl)methyl]benzoic acid Openeye Name: 2-[(5-chloro-2-nitro-phenyl)methyl]benzoic acid CAS Name: 2-[(5-chloro-2-nitrophenyl)methyl]benzoic acid IUPAC Name: 2-[(5-chloro-2-nitrophenyl)methyl]benzoic acid Traditional Name: 2-(5-chloro-2-nitro-benzyl)benzoic acid Formula: C14H10ClNO4 MolecularWeight: 291.6865

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=C(C=CC(=C2)Cl)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CC2=C(C=CC(=C2)Cl)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H10ClNO4/c15-11-5-6-13(16(19)20)10(8-11)7-9-3-1-2-4-12(9)14(17)18/h1-6,8H,7H2,(H,17,18)