4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N-[3-(diethylamino)propyl]-N-methyl-quinoline-3-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N-[3-(diethylamino)propyl]-N-methyl-quinoline-3-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-N-[3-(diethylamino)propyl]-N-methyl-quinoline-3-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-[3-(diethylamino)propyl]-N-methyl-3-quinolinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-[3-(diethylamino)propyl]-N-methylquinoline-3-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-N-[3-(diethylamino)propyl]-N-methyl-quinoline-3-carboxamide Formula: C27H32ClN5O2 MolecularWeight: 494.02828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN(C)C(=O)C1=CN=C2C=CC(=CC2=C1NCC3=CC(=C(C=C3)OC)Cl)C#N

Isomeric SMILES

CCN(CC)CCCN(C)C(=O)C1=CN=C2C=CC(=CC2=C1NCC3=CC(=C(C=C3)OC)Cl)C#N

InChI

InChI=1S/C27H32ClN5O2/c1-5-33(6-2)13-7-12-32(3)27(34)22-18-30-24-10-8-19(16-29)14-21(24)26(22)31-17-20-9-11-25(35-4)23(28)15-20/h8-11,14-15,18H,5-7,12-13,17H2,1-4H3,(H,30,31)