2-(3-chloranylsulfonyl-2-methoxy-5-nitro-phenoxy)ethanoic acid

Systemtic Name: 2-(3-chloranylsulfonyl-2-methoxy-5-nitro-phenoxy)ethanoic acid Openeye Name: 2-(3-chlorosulfonyl-2-methoxy-5-nitro-phenoxy)acetic acid CAS Name: 2-(3-chlorosulfonyl-2-methoxy-5-nitrophenoxy)acetic acid IUPAC Name: 2-(3-chlorosulfonyl-2-methoxy-5-nitrophenoxy)acetic acid Traditional Name: 2-(3-chlorosulfonyl-2-methoxy-5-nitro-phenoxy)acetic acid Formula: C9H8ClNO8S MolecularWeight: 325.67972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1S(=O)(=O)Cl)[N+](=O)[O-])OCC(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1S(=O)(=O)Cl)[N+](=O)[O-])OCC(=O)O

InChI

InChI=1S/C9H8ClNO8S/c1-18-9-6(19-4-8(12)13)2-5(11(14)15)3-7(9)20(10,16)17/h2-3H,4H2,1H3,(H,12,13)