methyl (2S,4R)-4-[(2-phenylphenyl)carbonylamino]-1-(quinolin-4-ylmethyl)pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R)-4-[(2-phenylphenyl)carbonylamino]-1-(quinolin-4-ylmethyl)pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R)-4-[(2-phenylbenzoyl)amino]-1-(4-quinolylmethyl)pyrrolidine-2-carboxylate CAS Name: (2S,4R)-4-[[oxo-(2-phenylphenyl)methyl]amino]-1-(4-quinolinylmethyl)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-4-[(2-phenylbenzoyl)amino]-1-(quinolin-4-ylmethyl)pyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-[(2-phenylbenzoyl)amino]-1-(4-quinolylmethyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C29H27N3O3 MolecularWeight: 465.54298

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CN1CC2=CC=NC3=CC=CC=C23)NC(=O)C4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

COC(=O)[C@@H]1C[C@H](CN1CC2=CC=NC3=CC=CC=C23)NC(=O)C4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C29H27N3O3/c1-35-29(34)27-17-22(19-32(27)18-21-15-16-30-26-14-8-7-12-24(21)26)31-28(33)25-13-6-5-11-23(25)20-9-3-2-4-10-20/h2-16,22,27H,17-19H2,1H3,(H,31,33)/t22-,27+/m1/s1