(2S,4S,5R)-1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-4-(methoxymethyl)-2-(2-methylpropyl)-5-(5-methylpyridin-2-yl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S,5R)-1-(4-tert-butyl-3-methoxy-phenyl)carbonyl-4-(methoxymethyl)-2-(2-methylpropyl)-5-(5-methylpyridin-2-yl)pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S,5R)-1-(4-tert-butyl-3-methoxy-benzoyl)-2-isobutyl-4-(methoxymethyl)-5-(5-methyl-2-pyridyl)pyrrolidine-2-carboxylic acid CAS Name: (2S,4S,5R)-1-[(4-tert-butyl-3-methoxyphenyl)-oxomethyl]-4-(methoxymethyl)-2-(2-methylpropyl)-5-(5-methyl-2-pyridinyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S,5R)-1-(4-tert-butyl-3-methoxybenzoyl)-4-(methoxymethyl)-2-(2-methylpropyl)-5-(5-methylpyridin-2-yl)pyrrolidine-2-carboxylic acid Traditional Name: (2S,4S,5R)-1-(4-tert-butyl-3-methoxy-benzoyl)-2-isobutyl-4-(methoxymethyl)-5-(5-methyl-2-pyridyl)proline Formula: C29H40N2O5 MolecularWeight: 496.6383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C2C(CC(N2C(=O)C3=CC(=C(C=C3)C(C)(C)C)OC)(CC(C)C)C(=O)O)COC

Isomeric SMILES

CC1=CN=C(C=C1)[C@H]2[C@H](C[C@@](N2C(=O)C3=CC(=C(C=C3)C(C)(C)C)OC)(CC(C)C)C(=O)O)COC

InChI

InChI=1S/C29H40N2O5/c1-18(2)14-29(27(33)34)15-21(17-35-7)25(23-12-9-19(3)16-30-23)31(29)26(32)20-10-11-22(28(4,5)6)24(13-20)36-8/h9-13,16,18,21,25H,14-15,17H2,1-8H3,(H,33,34)/t21-,25-,29+/m1/s1