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

Systemtic Name: 3-[[1-cyclopentylcarbonyl-3-(3-methylphenyl)carbonyl-imidazolidin-2-yl]carbonylamino]-3-(4-fluorophenyl)propanoic acid Openeye Name: 3-[[1-(cyclopentanecarbonyl)-3-(3-methylbenzoyl)imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propanoic acid CAS Name: 3-[[[1-[cyclopentyl(oxo)methyl]-3-[(3-methylphenyl)-oxomethyl]-2-imidazolidinyl]-oxomethyl]amino]-3-(4-fluorophenyl)propanoic acid IUPAC Name: 3-[[1-(cyclopentanecarbonyl)-3-(3-methylbenzoyl)imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propanoic acid Traditional Name: 3-[[1-(cyclopentanecarbonyl)-3-m-toluoyl-imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propionic acid Formula: C27H30FN3O5 MolecularWeight: 495.542603

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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)C4CCCC4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)C(=O)C4CCCC4

InChI

InChI=1S/C27H30FN3O5/c1-17-5-4-8-20(15-17)27(36)31-14-13-30(26(35)19-6-2-3-7-19)25(31)24(34)29-22(16-23(32)33)18-9-11-21(28)12-10-18/h4-5,8-12,15,19,22,25H,2-3,6-7,13-14,16H2,1H3,(H,29,34)(H,32,33)