3-[furan-2-ylmethyl-[(4-phenylphenyl)methyl]amino]-2-[[4-[4-(trifluoromethyl)phenyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[furan-2-ylmethyl-[(4-phenylphenyl)methyl]amino]-2-[[4-[4-(trifluoromethyl)phenyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[2-furylmethyl-[(4-phenylphenyl)methyl]amino]-2-[[4-[4-(trifluoromethyl)phenyl]benzoyl]amino]propanoic acid CAS Name: 3-[2-furanylmethyl-[(4-phenylphenyl)methyl]amino]-2-[[oxo-[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]amino]propanoic acid IUPAC Name: 3-[furan-2-ylmethyl-[(4-phenylphenyl)methyl]amino]-2-[[4-[4-(trifluoromethyl)phenyl]benzoyl]amino]propanoic acid Traditional Name: 3-[2-furfuryl-(4-phenylbenzyl)amino]-2-[[4-[4-(trifluoromethyl)phenyl]benzoyl]amino]propionic acid Formula: C35H29F3N2O4 MolecularWeight: 598.61097

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CN(CC3=CC=CO3)CC(C(=O)O)NC(=O)C4=CC=C(C=C4)C5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CN(CC3=CC=CO3)CC(C(=O)O)NC(=O)C4=CC=C(C=C4)C5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C35H29F3N2O4/c36-35(37,38)30-18-16-28(17-19-30)27-12-14-29(15-13-27)33(41)39-32(34(42)43)23-40(22-31-7-4-20-44-31)21-24-8-10-26(11-9-24)25-5-2-1-3-6-25/h1-20,32H,21-23H2,(H,39,41)(H,42,43)