2-propoxy-5-pyrrolidin-1-ylsulfonyl-benzoic acid

Systemtic Name: 2-propoxy-5-pyrrolidin-1-ylsulfonyl-benzoic acid Openeye Name: 2-propoxy-5-pyrrolidin-1-ylsulfonyl-benzoic acid CAS Name: 2-propoxy-5-(1-pyrrolidinylsulfonyl)benzoic acid IUPAC Name: 2-propoxy-5-pyrrolidin-1-ylsulfonylbenzoic acid Traditional Name: 2-propoxy-5-pyrrolidinosulfonyl-benzoic acid Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)O

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)O

InChI

InChI=1S/C14H19NO5S/c1-2-9-20-13-6-5-11(10-12(13)14(16)17)21(18,19)15-7-3-4-8-15/h5-6,10H,2-4,7-9H2,1H3,(H,16,17)