5-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-1,2-oxazole-3-carboxylic acid

Systemtic Name: 5-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-1,2-oxazole-3-carboxylic acid Openeye Name: 5-(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)isoxazole-3-carboxylic acid CAS Name: 5-[4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-3-isoxazolecarboxylic acid IUPAC Name: 5-(4-methoxy-3-pyrrolidin-1-ylsulfonylphenyl)-1,2-oxazole-3-carboxylic acid Traditional Name: 5-(4-methoxy-3-pyrrolidinosulfonyl-phenyl)isoxazole-3-carboxylic acid Formula: C15H16N2O6S MolecularWeight: 352.36234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NO2)C(=O)O)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NO2)C(=O)O)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C15H16N2O6S/c1-22-12-5-4-10(13-9-11(15(18)19)16-23-13)8-14(12)24(20,21)17-6-2-3-7-17/h4-5,8-9H,2-3,6-7H2,1H3,(H,18,19)