4-[[(3R)-3-carboxy-2,2,3-trimethyl-cyclopentyl]carbonylamino]benzoic acid

Systemtic Name: 4-[[(3R)-3-carboxy-2,2,3-trimethyl-cyclopentyl]carbonylamino]benzoic acid Openeye Name: 4-[[(3R)-3-carboxy-2,2,3-trimethyl-cyclopentanecarbonyl]amino]benzoic acid CAS Name: 4-[[[(3R)-3-carboxy-2,2,3-trimethylcyclopentyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[(3R)-3-carboxy-2,2,3-trimethylcyclopentanecarbonyl]amino]benzoic acid Traditional Name: 4-[[(3R)-3-carboxy-2,2,3-trimethyl-cyclopentanecarbonyl]amino]benzoic acid Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)O)C(=O)NC2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

C[C@]1(CCC(C1(C)C)C(=O)NC2=CC=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C17H21NO5/c1-16(2)12(8-9-17(16,3)15(22)23)13(19)18-11-6-4-10(5-7-11)14(20)21/h4-7,12H,8-9H2,1-3H3,(H,18,19)(H,20,21)(H,22,23)/t12?,17-/m0/s1