2-(5-chloranyl-2-nitro-phenyl)butanoic acid

Systemtic Name: 2-(5-chloranyl-2-nitro-phenyl)butanoic acid Openeye Name: 2-(5-chloro-2-nitro-phenyl)butanoic acid CAS Name: 2-(5-chloro-2-nitrophenyl)butanoic acid IUPAC Name: 2-(5-chloro-2-nitrophenyl)butanoic acid Traditional Name: 2-(5-chloro-2-nitro-phenyl)butyric acid Formula: C10H10ClNO4 MolecularWeight: 243.6437

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClNO4/c1-2-7(10(13)14)8-5-6(11)3-4-9(8)12(15)16/h3-5,7H,2H2,1H3,(H,13,14)