2-[naphthalen-2-ylcarbonyl-[3-phenyl-2-(quinolin-8-ylcarbonylamino)propyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[naphthalen-2-ylcarbonyl-[3-phenyl-2-(quinolin-8-ylcarbonylamino)propyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[naphthalene-2-carbonyl-[3-phenyl-2-(quinoline-8-carbonylamino)propyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-naphthalenyl(oxo)methyl]-[2-[[oxo(8-quinolinyl)methyl]amino]-3-phenylpropyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[naphthalene-2-carbonyl-[3-phenyl-2-(quinoline-8-carbonylamino)propyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[2-naphthoyl-[3-phenyl-2-(quinoline-8-carbonylamino)propyl]amino]-3-phenyl-propionic acid Formula: C39H33N3O4 MolecularWeight: 607.69702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CN(C(CC2=CC=CC=C2)C(=O)O)C(=O)C3=CC4=CC=CC=C4C=C3)NC(=O)C5=CC=CC6=C5N=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)CC(CN(C(CC2=CC=CC=C2)C(=O)O)C(=O)C3=CC4=CC=CC=C4C=C3)NC(=O)C5=CC=CC6=C5N=CC=C6

InChI

InChI=1S/C39H33N3O4/c43-37(34-19-9-17-30-18-10-22-40-36(30)34)41-33(23-27-11-3-1-4-12-27)26-42(35(39(45)46)24-28-13-5-2-6-14-28)38(44)32-21-20-29-15-7-8-16-31(29)25-32/h1-22,25,33,35H,23-24,26H2,(H,41,43)(H,45,46)