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

Systemtic Name: 1-[3,3-dimethyl-2-[(2-nitrophenyl)amino]butanoyl]-2-(7-methoxy-2-phenyl-quinolin-4-yl)oxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[3,3-dimethyl-2-(2-nitroanilino)butanoyl]-2-[(7-methoxy-2-phenyl-4-quinolyl)oxy]pyrrolidine-2-carboxylic acid CAS Name: 1-[3,3-dimethyl-2-(2-nitroanilino)-1-oxobutyl]-2-[(7-methoxy-2-phenyl-4-quinolinyl)oxy]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3,3-dimethyl-2-(2-nitroanilino)butanoyl]-2-(7-methoxy-2-phenylquinolin-4-yl)oxypyrrolidine-2-carboxylic acid Traditional Name: 1-[3,3-dimethyl-2-(2-nitroanilino)butanoyl]-2-[(7-methoxy-2-phenyl-4-quinolyl)oxy]proline Formula: C33H34N4O7 MolecularWeight: 598.64566

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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)NC5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(C(=O)N1CCCC1(C(=O)O)OC2=CC(=NC3=C2C=CC(=C3)OC)C4=CC=CC=C4)NC5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C33H34N4O7/c1-32(2,3)29(35-24-13-8-9-14-27(24)37(41)42)30(38)36-18-10-17-33(36,31(39)40)44-28-20-25(21-11-6-5-7-12-21)34-26-19-22(43-4)15-16-23(26)28/h5-9,11-16,19-20,29,35H,10,17-18H2,1-4H3,(H,39,40)