2-methoxy-5-(pyridin-2-ylmethylsulfonyl)benzoic acid

Systemtic Name: 2-methoxy-5-(pyridin-2-ylmethylsulfonyl)benzoic acid Openeye Name: 2-methoxy-5-(2-pyridylmethylsulfonyl)benzoic acid CAS Name: 2-methoxy-5-(2-pyridinylmethylsulfonyl)benzoic acid IUPAC Name: 2-methoxy-5-(pyridin-2-ylmethylsulfonyl)benzoic acid Traditional Name: 2-methoxy-5-(2-pyridylmethylsulfonyl)benzoic acid Formula: C14H13NO5S MolecularWeight: 307.32172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)CC2=CC=CC=N2)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)CC2=CC=CC=N2)C(=O)O

InChI

InChI=1S/C14H13NO5S/c1-20-13-6-5-11(8-12(13)14(16)17)21(18,19)9-10-4-2-3-7-15-10/h2-8H,9H2,1H3,(H,16,17)