3-chloranylsulfonyl-4-pentoxy-benzoic acid

Systemtic Name: 3-chloranylsulfonyl-4-pentoxy-benzoic acid Openeye Name: 3-chlorosulfonyl-4-pentoxy-benzoic acid CAS Name: 3-chlorosulfonyl-4-pentoxybenzoic acid IUPAC Name: 3-chlorosulfonyl-4-pentoxybenzoic acid Traditional Name: 4-amoxy-3-chlorosulfonyl-benzoic acid Formula: C12H15ClO5S MolecularWeight: 306.7625

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)Cl

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)Cl

InChI

InChI=1S/C12H15ClO5S/c1-2-3-4-7-18-10-6-5-9(12(14)15)8-11(10)19(13,16)17/h5-6,8H,2-4,7H2,1H3,(H,14,15)