3-(2-aminocarbonylpyrrolidin-1-yl)sulfonyl-4-methyl-benzoic acid

Systemtic Name: 3-(2-aminocarbonylpyrrolidin-1-yl)sulfonyl-4-methyl-benzoic acid Openeye Name: 3-(2-carbamoylpyrrolidin-1-yl)sulfonyl-4-methyl-benzoic acid CAS Name: 3-[(2-carbamoyl-1-pyrrolidinyl)sulfonyl]-4-methylbenzoic acid IUPAC Name: 3-(2-carbamoylpyrrolidin-1-yl)sulfonyl-4-methylbenzoic acid Traditional Name: 3-(2-carbamoylpyrrolidino)sulfonyl-4-methyl-benzoic acid Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCCC2C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCCC2C(=O)N

InChI

InChI=1S/C13H16N2O5S/c1-8-4-5-9(13(17)18)7-11(8)21(19,20)15-6-2-3-10(15)12(14)16/h4-5,7,10H,2-3,6H2,1H3,(H2,14,16)(H,17,18)