methyl (2S,4R)-1-[(3-hydroxyphenyl)methyl]-4-[(2-phenylquinolin-4-yl)carbonylamino]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R)-1-[(3-hydroxyphenyl)methyl]-4-[(2-phenylquinolin-4-yl)carbonylamino]pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R)-1-[(3-hydroxyphenyl)methyl]-4-[(2-phenylquinoline-4-carbonyl)amino]pyrrolidine-2-carboxylate CAS Name: (2S,4R)-1-[(3-hydroxyphenyl)methyl]-4-[[oxo-(2-phenyl-4-quinolinyl)methyl]amino]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-1-[(3-hydroxyphenyl)methyl]-4-[(2-phenylquinoline-4-carbonyl)amino]pyrrolidine-2-carboxylate Traditional Name: (2S,4R)-1-(3-hydroxybenzyl)-4-[(2-phenylquinoline-4-carbonyl)amino]pyrrolidine-2-carboxylic acid methyl ester Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CN1CC2=CC(=CC=C2)O)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC(=O)[C@@H]1C[C@H](CN1CC2=CC(=CC=C2)O)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C29H27N3O4/c1-36-29(35)27-15-21(18-32(27)17-19-8-7-11-22(33)14-19)30-28(34)24-16-26(20-9-3-2-4-10-20)31-25-13-6-5-12-23(24)25/h2-14,16,21,27,33H,15,17-18H2,1H3,(H,30,34)/t21-,27+/m1/s1