4-butoxy-3-chloranylsulfonyl-benzoic acid

Systemtic Name: 4-butoxy-3-chloranylsulfonyl-benzoic acid Openeye Name: 4-butoxy-3-chlorosulfonyl-benzoic acid CAS Name: 4-butoxy-3-chlorosulfonylbenzoic acid IUPAC Name: 4-butoxy-3-chlorosulfonylbenzoic acid Traditional Name: 4-butoxy-3-chlorosulfonyl-benzoic acid Formula: C11H13ClO5S MolecularWeight: 292.73592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)Cl

InChI

InChI=1S/C11H13ClO5S/c1-2-3-6-17-9-5-4-8(11(13)14)7-10(9)18(12,15)16/h4-5,7H,2-3,6H2,1H3,(H,13,14)