2-[2-[2-(2,2-dimethylbutanoylamino)phenyl]ethylcarbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[2-[2-(2,2-dimethylbutanoylamino)phenyl]ethylcarbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[2-[2-(2,2-dimethylbutanoylamino)phenyl]ethylcarbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[2-[2-[(2,2-dimethyl-1-oxobutyl)amino]phenyl]ethylamino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[2-[2-(2,2-dimethylbutanoylamino)phenyl]ethylcarbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[2-[2-(2,2-dimethylbutanoylamino)phenyl]ethylcarbamoyl]cyclohexanecarboxylic acid Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)NC1=CC=CC=C1CCNC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CCC(C)(C)C(=O)NC1=CC=CC=C1CCNC(=O)C2CCCCC2C(=O)O

InChI

InChI=1S/C22H32N2O4/c1-4-22(2,3)21(28)24-18-12-8-5-9-15(18)13-14-23-19(25)16-10-6-7-11-17(16)20(26)27/h5,8-9,12,16-17H,4,6-7,10-11,13-14H2,1-3H3,(H,23,25)(H,24,28)(H,26,27)