1,2,2-trimethyl-3-[methyl-[3-(4-methylphenyl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]carbamoyl]cyclopentane-1-carboxylic acid

Systemtic Name: 1,2,2-trimethyl-3-[methyl-[3-(4-methylphenyl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]carbamoyl]cyclopentane-1-carboxylic acid Openeye Name: 3-[[2-hydroxy-2-oxo-1-(p-tolylmethyl)ethyl]-methyl-carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid CAS Name: 3-[[[1-hydroxy-3-(4-methylphenyl)-1-oxopropan-2-yl]-methylamino]-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylic acid IUPAC Name: 3-[[1-hydroxy-3-(4-methylphenyl)-1-oxopropan-2-yl]-methylcarbamoyl]-1,2,2-trimethylcyclopentane-1-carboxylic acid Traditional Name: 3-[[2-hydroxy-2-keto-1-(4-methylbenzyl)ethyl]-methyl-carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid Formula: C21H29NO5 MolecularWeight: 375.45866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C(=O)O)N(C)C(=O)C2CCC(C2(C)C)(C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CC(C(=O)O)N(C)C(=O)C2CCC(C2(C)C)(C)C(=O)O

InChI

InChI=1S/C21H29NO5/c1-13-6-8-14(9-7-13)12-16(18(24)25)22(5)17(23)15-10-11-21(4,19(26)27)20(15,2)3/h6-9,15-16H,10-12H2,1-5H3,(H,24,25)(H,26,27)