1-[2-azanyl-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl]butanoyl]-4-(7-methoxy-2-phenyl-quinolin-4-yl)oxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-azanyl-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl]butanoyl]-4-(7-methoxy-2-phenyl-quinolin-4-yl)oxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-(2-amino-2-tert-butoxycarbonyl-3-methyl-butanoyl)-4-[(7-methoxy-2-phenyl-4-quinolyl)oxy]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-amino-3-methyl-2-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-oxobutyl]-4-[(7-methoxy-2-phenyl-4-quinolinyl)oxy]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-amino-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl]butanoyl]-4-(7-methoxy-2-phenylquinolin-4-yl)oxypyrrolidine-2-carboxylic acid Traditional Name: 1-(2-amino-2-tert-butoxycarbonyl-3-methyl-butanoyl)-4-[(7-methoxy-2-phenyl-4-quinolyl)oxy]proline Formula: C31H37N3O7 MolecularWeight: 563.64138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC(CC1C(=O)O)OC2=CC(=NC3=C2C=CC(=C3)OC)C4=CC=CC=C4)(C(=O)OC(C)(C)C)N

Isomeric SMILES

CC(C)C(C(=O)N1CC(CC1C(=O)O)OC2=CC(=NC3=C2C=CC(=C3)OC)C4=CC=CC=C4)(C(=O)OC(C)(C)C)N

InChI

InChI=1S/C31H37N3O7/c1-18(2)31(32,29(38)41-30(3,4)5)28(37)34-17-21(15-25(34)27(35)36)40-26-16-23(19-10-8-7-9-11-19)33-24-14-20(39-6)12-13-22(24)26/h7-14,16,18,21,25H,15,17,32H2,1-6H3,(H,35,36)