3-(4-chlorophenyl)-4-nitro-butanoic acid

Systemtic Name: 3-(4-chlorophenyl)-4-nitro-butanoic acid Openeye Name: 3-(4-chlorophenyl)-4-nitro-butanoic acid CAS Name: 3-(4-chlorophenyl)-4-nitrobutanoic acid IUPAC Name: 3-(4-chlorophenyl)-4-nitrobutanoic acid Traditional Name: 3-(4-chlorophenyl)-4-nitro-butyric acid Formula: C10H10ClNO4 MolecularWeight: 243.6437

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CC(=O)O)C[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C(CC(=O)O)C[N+](=O)[O-])Cl

InChI

InChI=1S/C10H10ClNO4/c11-9-3-1-7(2-4-9)8(5-10(13)14)6-12(15)16/h1-4,8H,5-6H2,(H,13,14)