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

Systemtic Name: 3-[[1-cyclopropylcarbonyl-3-(3-methoxyphenyl)carbonyl-imidazolidin-2-yl]carbonylamino]-3-(4-fluorophenyl)propanoic acid Openeye Name: 3-[[1-(cyclopropanecarbonyl)-3-(3-methoxybenzoyl)imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propanoic acid CAS Name: 3-[[[1-[cyclopropyl(oxo)methyl]-3-[(3-methoxyphenyl)-oxomethyl]-2-imidazolidinyl]-oxomethyl]amino]-3-(4-fluorophenyl)propanoic acid IUPAC Name: 3-[[1-(cyclopropanecarbonyl)-3-(3-methoxybenzoyl)imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propanoic acid Traditional Name: 3-[[1-(cyclopropanecarbonyl)-3-m-anisoyl-imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propionic acid Formula: C25H26FN3O6 MolecularWeight: 483.488843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)C(=O)C4CC4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)C(=O)C4CC4

InChI

InChI=1S/C25H26FN3O6/c1-35-19-4-2-3-17(13-19)25(34)29-12-11-28(24(33)16-5-6-16)23(29)22(32)27-20(14-21(30)31)15-7-9-18(26)10-8-15/h2-4,7-10,13,16,20,23H,5-6,11-12,14H2,1H3,(H,27,32)(H,30,31)