1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(3-pyridin-4-ylisoquinolin-1-yl)oxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(3-pyridin-4-ylisoquinolin-1-yl)oxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-tert-butoxycarbonyl-4-[[3-(4-pyridyl)-1-isoquinolyl]oxy]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-[(3-pyridin-4-yl-1-isoquinolinyl)oxy]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-methylpropan-2-yl)oxycarbonyl]-4-(3-pyridin-4-ylisoquinolin-1-yl)oxypyrrolidine-2-carboxylic acid Traditional Name: 1-tert-butoxycarbonyl-4-[[3-(4-pyridyl)-1-isoquinolyl]oxy]proline Formula: C24H25N3O5 MolecularWeight: 435.4724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)O)OC2=NC(=CC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)O)OC2=NC(=CC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C24H25N3O5/c1-24(2,3)32-23(30)27-14-17(13-20(27)22(28)29)31-21-18-7-5-4-6-16(18)12-19(26-21)15-8-10-25-11-9-15/h4-12,17,20H,13-14H2,1-3H3,(H,28,29)