4-(2-chloranylsulfonyl-4-nitro-phenoxy)butanoic acid

Systemtic Name: 4-(2-chloranylsulfonyl-4-nitro-phenoxy)butanoic acid Openeye Name: 4-(2-chlorosulfonyl-4-nitro-phenoxy)butanoic acid CAS Name: 4-(2-chlorosulfonyl-4-nitrophenoxy)butanoic acid IUPAC Name: 4-(2-chlorosulfonyl-4-nitrophenoxy)butanoic acid Traditional Name: 4-(2-chlorosulfonyl-4-nitro-phenoxy)butyric acid Formula: C10H10ClNO7S MolecularWeight: 323.7069

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10ClNO7S/c11-20(17,18)9-6-7(12(15)16)3-4-8(9)19-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)