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

Systemtic Name: 3-(4-fluorophenyl)-3-[[1-(3-methylphenyl)carbonyl-3-phenoxycarbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-(4-fluorophenyl)-3-[[1-(3-methylbenzoyl)-3-phenoxycarbonyl-imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-(4-fluorophenyl)-3-[[[1-[(3-methylphenyl)-oxomethyl]-3-[oxo(phenoxy)methyl]-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-fluorophenyl)-3-[[1-(3-methylbenzoyl)-3-phenoxycarbonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-[(1-carbophenoxy-3-m-toluoyl-imidazolidine-2-carbonyl)amino]-3-(4-fluorophenyl)propionic acid Formula: C28H26FN3O6 MolecularWeight: 519.520943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)C(=O)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C28H26FN3O6/c1-18-6-5-7-20(16-18)27(36)31-14-15-32(28(37)38-22-8-3-2-4-9-22)26(31)25(35)30-23(17-24(33)34)19-10-12-21(29)13-11-19/h2-13,16,23,26H,14-15,17H2,1H3,(H,30,35)(H,33,34)