3-cyclohexyl-3-[[1-(3,3-dimethylbutanoyl)-3-(4-methylphenyl)carbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[[1-(3,3-dimethylbutanoyl)-3-(4-methylphenyl)carbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[1-(3,3-dimethylbutanoyl)-3-(4-methylbenzoyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-(3,3-dimethyl-1-oxobutyl)-3-[(4-methylphenyl)-oxomethyl]-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[1-(3,3-dimethylbutanoyl)-3-(4-methylbenzoyl)imidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[[1-(3,3-dimethylbutanoyl)-3-p-toluoyl-imidazolidine-2-carbonyl]amino]propionic acid Formula: C27H39N3O5 MolecularWeight: 485.61566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)CC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)CC(C)(C)C

InChI

InChI=1S/C27H39N3O5/c1-18-10-12-20(13-11-18)26(35)30-15-14-29(22(31)17-27(2,3)4)25(30)24(34)28-21(16-23(32)33)19-8-6-5-7-9-19/h10-13,19,21,25H,5-9,14-17H2,1-4H3,(H,28,34)(H,32,33)