3-cyclohexyl-3-[[1-(4-fluorophenyl)carbonyl-3-phenoxycarbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[[1-(4-fluorophenyl)carbonyl-3-phenoxycarbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[1-(4-fluorobenzoyl)-3-phenoxycarbonyl-imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-[(4-fluorophenyl)-oxomethyl]-3-[oxo(phenoxy)methyl]-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[1-(4-fluorobenzoyl)-3-phenoxycarbonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-[[1-carbophenoxy-3-(4-fluorobenzoyl)imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propionic acid Formula: C27H30FN3O6 MolecularWeight: 511.542003

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC(=O)O)NC(=O)C2N(CCN2C(=O)OC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(CC1)C(CC(=O)O)NC(=O)C2N(CCN2C(=O)OC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H30FN3O6/c28-20-13-11-19(12-14-20)26(35)30-15-16-31(27(36)37-21-9-5-2-6-10-21)25(30)24(34)29-22(17-23(32)33)18-7-3-1-4-8-18/h2,5-6,9-14,18,22,25H,1,3-4,7-8,15-17H2,(H,29,34)(H,32,33)