2-[4-(2,2-dimethylpropanoylamino)piperidin-1-yl]sulfonylbenzoic acid

Systemtic Name: 2-[4-(2,2-dimethylpropanoylamino)piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 2-[[4-(2,2-dimethylpropanoylamino)-1-piperidyl]sulfonyl]benzoic acid CAS Name: 2-[[4-[(2,2-dimethyl-1-oxopropyl)amino]-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 2-[4-(2,2-dimethylpropanoylamino)piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 2-[4-(pivaloylamino)piperidino]sulfonylbenzoic acid Formula: C17H24N2O5S MolecularWeight: 368.44786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)NC1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C17H24N2O5S/c1-17(2,3)16(22)18-12-8-10-19(11-9-12)25(23,24)14-7-5-4-6-13(14)15(20)21/h4-7,12H,8-11H2,1-3H3,(H,18,22)(H,20,21)