3-[[4-(2,3-dimethylphenoxy)phenyl]carbamoyl]-1,2,2-trimethyl-cyclopentane-1-carboxylic acid

Systemtic Name: 3-[[4-(2,3-dimethylphenoxy)phenyl]carbamoyl]-1,2,2-trimethyl-cyclopentane-1-carboxylic acid Openeye Name: 3-[[4-(2,3-dimethylphenoxy)phenyl]carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid CAS Name: 3-[[4-(2,3-dimethylphenoxy)anilino]-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylic acid IUPAC Name: 3-[[4-(2,3-dimethylphenoxy)phenyl]carbamoyl]-1,2,2-trimethylcyclopentane-1-carboxylic acid Traditional Name: 3-[[4-(2,3-dimethylphenoxy)phenyl]carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid Formula: C24H29NO4 MolecularWeight: 395.49136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC2=CC=C(C=C2)NC(=O)C3CCC(C3(C)C)(C)C(=O)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)OC2=CC=C(C=C2)NC(=O)C3CCC(C3(C)C)(C)C(=O)O)C

InChI

InChI=1S/C24H29NO4/c1-15-7-6-8-20(16(15)2)29-18-11-9-17(10-12-18)25-21(26)19-13-14-24(5,22(27)28)23(19,3)4/h6-12,19H,13-14H2,1-5H3,(H,25,26)(H,27,28)