2-[[2-chloranyl-4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-quinolin-3-yl]methoxymethyl]pyrrolidine-1-carboxylic acid

Systemtic Name: 2-[[2-chloranyl-4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-quinolin-3-yl]methoxymethyl]pyrrolidine-1-carboxylic acid Openeye Name: 2-[[2-chloro-4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-3-quinolyl]methoxymethyl]pyrrolidine-1-carboxylic acid CAS Name: 2-[[2-chloro-4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-3-quinolinyl]methoxymethyl]-1-pyrrolidinecarboxylic acid IUPAC Name: 2-[[2-chloro-4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyanoquinolin-3-yl]methoxymethyl]pyrrolidine-1-carboxylic acid Traditional Name: 2-[[2-chloro-4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-3-quinolyl]methoxymethyl]pyrrolidine-1-carboxylic acid Formula: C25H24Cl2N4O4 MolecularWeight: 515.38846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C(C(=NC3=C2C=C(C=C3)C#N)Cl)COCC4CCCN4C(=O)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C(C(=NC3=C2C=C(C=C3)C#N)Cl)COCC4CCCN4C(=O)O)Cl

InChI

InChI=1S/C25H24Cl2N4O4/c1-34-22-7-5-16(10-20(22)26)12-29-23-18-9-15(11-28)4-6-21(18)30-24(27)19(23)14-35-13-17-3-2-8-31(17)25(32)33/h4-7,9-10,17H,2-3,8,12-14H2,1H3,(H,29,30)(H,32,33)