4-[(3-chlorophenyl)carbonylamino]-5-[(4,4-dimethylcyclohexyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[(3-chlorophenyl)carbonylamino]-5-[(4,4-dimethylcyclohexyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-[(3-chlorobenzoyl)amino]-5-[(4,4-dimethylcyclohexyl)amino]-5-oxo-pentanoic acid CAS Name: 4-[[(3-chlorophenyl)-oxomethyl]amino]-5-[(4,4-dimethylcyclohexyl)amino]-5-oxopentanoic acid IUPAC Name: 4-[(3-chlorobenzoyl)amino]-5-[(4,4-dimethylcyclohexyl)amino]-5-oxopentanoic acid Traditional Name: 4-[(3-chlorobenzoyl)amino]-5-[(4,4-dimethylcyclohexyl)amino]-5-keto-valeric acid Formula: C20H27ClN2O4 MolecularWeight: 394.89238

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1)NC(=O)C(CCC(=O)O)NC(=O)C2=CC(=CC=C2)Cl)C

Isomeric SMILES

CC1(CCC(CC1)NC(=O)C(CCC(=O)O)NC(=O)C2=CC(=CC=C2)Cl)C

InChI

InChI=1S/C20H27ClN2O4/c1-20(2)10-8-15(9-11-20)22-19(27)16(6-7-17(24)25)23-18(26)13-4-3-5-14(21)12-13/h3-5,12,15-16H,6-11H2,1-2H3,(H,22,27)(H,23,26)(H,24,25)