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

Systemtic Name: 3-[[1-ethanoyl-3-(4-methylphenyl)carbonyl-imidazolidin-2-yl]carbonylamino]-3-(4-fluorophenyl)propanoic acid Openeye Name: 3-[[1-acetyl-3-(4-methylbenzoyl)imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propanoic acid CAS Name: 3-[[[1-acetyl-3-[(4-methylphenyl)-oxomethyl]-2-imidazolidinyl]-oxomethyl]amino]-3-(4-fluorophenyl)propanoic acid IUPAC Name: 3-[[1-acetyl-3-(4-methylbenzoyl)imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propanoic acid Traditional Name: 3-[(1-acetyl-3-p-toluoyl-imidazolidine-2-carbonyl)amino]-3-(4-fluorophenyl)propionic acid Formula: C23H24FN3O5 MolecularWeight: 441.452163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24FN3O5/c1-14-3-5-17(6-4-14)23(32)27-12-11-26(15(2)28)22(27)21(31)25-19(13-20(29)30)16-7-9-18(24)10-8-16/h3-10,19,22H,11-13H2,1-2H3,(H,25,31)(H,29,30)