2-(4-chloranylsulfonyl-5-methyl-2-nitro-phenoxy)ethanoic acid

Systemtic Name: 2-(4-chloranylsulfonyl-5-methyl-2-nitro-phenoxy)ethanoic acid Openeye Name: 2-(4-chlorosulfonyl-5-methyl-2-nitro-phenoxy)acetic acid CAS Name: 2-(4-chlorosulfonyl-5-methyl-2-nitrophenoxy)acetic acid IUPAC Name: 2-(4-chlorosulfonyl-5-methyl-2-nitrophenoxy)acetic acid Traditional Name: 2-(4-chlorosulfonyl-5-methyl-2-nitro-phenoxy)acetic acid Formula: C9H8ClNO7S MolecularWeight: 309.68032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)Cl)[N+](=O)[O-])OCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)Cl)[N+](=O)[O-])OCC(=O)O

InChI

InChI=1S/C9H8ClNO7S/c1-5-2-7(18-4-9(12)13)6(11(14)15)3-8(5)19(10,16)17/h2-3H,4H2,1H3,(H,12,13)