3-[(5-chloranyl-2-phenoxy-phenyl)carbamoyl]-1,2,2,3-tetramethyl-cyclopentane-1-carboxylic acid

Systemtic Name: 3-[(5-chloranyl-2-phenoxy-phenyl)carbamoyl]-1,2,2,3-tetramethyl-cyclopentane-1-carboxylic acid Openeye Name: 3-[(5-chloro-2-phenoxy-phenyl)carbamoyl]-1,2,2,3-tetramethyl-cyclopentanecarboxylic acid CAS Name: 3-[(5-chloro-2-phenoxyanilino)-oxomethyl]-1,2,2,3-tetramethyl-1-cyclopentanecarboxylic acid IUPAC Name: 3-[(5-chloro-2-phenoxyphenyl)carbamoyl]-1,2,2,3-tetramethylcyclopentane-1-carboxylic acid Traditional Name: 3-[(5-chloro-2-phenoxy-phenyl)carbamoyl]-1,2,2,3-tetramethyl-cyclopentanecarboxylic acid Formula: C23H26ClNO4 MolecularWeight: 415.90984

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)O)(C)C(=O)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3)C

Isomeric SMILES

CC1(C(CCC1(C)C(=O)O)(C)C(=O)NC2=C(C=CC(=C2)Cl)OC3=CC=CC=C3)C

InChI

InChI=1S/C23H26ClNO4/c1-21(2)22(3,12-13-23(21,4)20(27)28)19(26)25-17-14-15(24)10-11-18(17)29-16-8-6-5-7-9-16/h5-11,14H,12-13H2,1-4H3,(H,25,26)(H,27,28)