3-cyclohexyl-3-[[1-[(3-fluorophenyl)carbamoyl]-3-phenylmethoxycarbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[[1-[(3-fluorophenyl)carbamoyl]-3-phenylmethoxycarbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-[[1-benzyloxycarbonyl-3-[(3-fluorophenyl)carbamoyl]imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-[(3-fluoroanilino)-oxomethyl]-3-phenylmethoxycarbonyl-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[1-[(3-fluorophenyl)carbamoyl]-3-phenylmethoxycarbonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-[[1-carbobenzoxy-3-[(3-fluorophenyl)carbamoyl]imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propionic acid Formula: C28H33FN4O6 MolecularWeight: 540.583223

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC(=O)O)NC(=O)C2N(CCN2C(=O)OCC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)F

Isomeric SMILES

C1CCC(CC1)C(CC(=O)O)NC(=O)C2N(CCN2C(=O)OCC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)F

InChI

InChI=1S/C28H33FN4O6/c29-21-12-7-13-22(16-21)30-27(37)32-14-15-33(28(38)39-18-19-8-3-1-4-9-19)26(32)25(36)31-23(17-24(34)35)20-10-5-2-6-11-20/h1,3-4,7-9,12-13,16,20,23,26H,2,5-6,10-11,14-15,17-18H2,(H,30,37)(H,31,36)(H,34,35)