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

Systemtic Name: 1-[2-(2,2-dimethylpropanoylamino)-3,3-dimethyl-butanoyl]-2-(7-methoxy-2-phenyl-quinolin-4-yl)oxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(2,2-dimethylpropanoylamino)-3,3-dimethyl-butanoyl]-2-[(7-methoxy-2-phenyl-4-quinolyl)oxy]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(2,2-dimethyl-1-oxopropyl)amino]-3,3-dimethyl-1-oxobutyl]-2-[(7-methoxy-2-phenyl-4-quinolinyl)oxy]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(2,2-dimethylpropanoylamino)-3,3-dimethylbutanoyl]-2-(7-methoxy-2-phenylquinolin-4-yl)oxypyrrolidine-2-carboxylic acid Traditional Name: 1-[3,3-dimethyl-2-(pivaloylamino)butanoyl]-2-[(7-methoxy-2-phenyl-4-quinolyl)oxy]proline Formula: C32H39N3O6 MolecularWeight: 561.66856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CCCC1(C(=O)O)OC2=CC(=NC3=C2C=CC(=C3)OC)C4=CC=CC=C4)NC(=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C(C(=O)N1CCCC1(C(=O)O)OC2=CC(=NC3=C2C=CC(=C3)OC)C4=CC=CC=C4)NC(=O)C(C)(C)C

InChI

InChI=1S/C32H39N3O6/c1-30(2,3)26(34-28(37)31(4,5)6)27(36)35-17-11-16-32(35,29(38)39)41-25-19-23(20-12-9-8-10-13-20)33-24-18-21(40-7)14-15-22(24)25/h8-10,12-15,18-19,26H,11,16-17H2,1-7H3,(H,34,37)(H,38,39)