1-[2-(2-cyclopropylethanoylamino)-3,3-dimethyl-butanoyl]-4-(7-methoxy-2-phenyl-quinolin-4-yl)oxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(2-cyclopropylethanoylamino)-3,3-dimethyl-butanoyl]-4-(7-methoxy-2-phenyl-quinolin-4-yl)oxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(2-cyclopropylacetyl)amino]-3,3-dimethyl-butanoyl]-4-[(7-methoxy-2-phenyl-4-quinolyl)oxy]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(2-cyclopropyl-1-oxoethyl)amino]-3,3-dimethyl-1-oxobutyl]-4-[(7-methoxy-2-phenyl-4-quinolinyl)oxy]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(2-cyclopropylacetyl)amino]-3,3-dimethylbutanoyl]-4-(7-methoxy-2-phenylquinolin-4-yl)oxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(2-cyclopropylacetyl)amino]-3,3-dimethyl-butanoyl]-4-[(7-methoxy-2-phenyl-4-quinolyl)oxy]proline Formula: C32H37N3O6 MolecularWeight: 559.65268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CC(CC1C(=O)O)OC2=CC(=NC3=C2C=CC(=C3)OC)C4=CC=CC=C4)NC(=O)CC5CC5

Isomeric SMILES

CC(C)(C)C(C(=O)N1CC(CC1C(=O)O)OC2=CC(=NC3=C2C=CC(=C3)OC)C4=CC=CC=C4)NC(=O)CC5CC5

InChI

InChI=1S/C32H37N3O6/c1-32(2,3)29(34-28(36)14-19-10-11-19)30(37)35-18-22(16-26(35)31(38)39)41-27-17-24(20-8-6-5-7-9-20)33-25-15-21(40-4)12-13-23(25)27/h5-9,12-13,15,17,19,22,26,29H,10-11,14,16,18H2,1-4H3,(H,34,36)(H,38,39)