3-[[(4-chlorophenyl)carbonylamino]carbamoyl]-1,2,2-trimethyl-cyclopentane-1-carboxylic acid

Systemtic Name: 3-[[(4-chlorophenyl)carbonylamino]carbamoyl]-1,2,2-trimethyl-cyclopentane-1-carboxylic acid Openeye Name: 3-[[(4-chlorobenzoyl)amino]carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid CAS Name: 3-[[[(4-chlorophenyl)-oxomethyl]hydrazo]-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylic acid IUPAC Name: 3-[[(4-chlorobenzoyl)amino]carbamoyl]-1,2,2-trimethylcyclopentane-1-carboxylic acid Traditional Name: 3-[[(4-chlorobenzoyl)amino]carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid Formula: C17H21ClN2O4 MolecularWeight: 352.81264

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)O)C(=O)NNC(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1(C(CCC1(C)C(=O)O)C(=O)NNC(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C17H21ClN2O4/c1-16(2)12(8-9-17(16,3)15(23)24)14(22)20-19-13(21)10-4-6-11(18)7-5-10/h4-7,12H,8-9H2,1-3H3,(H,19,21)(H,20,22)(H,23,24)