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

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N-(3-methoxypropyl)quinoline-3-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-N-(3-methoxypropyl)quinoline-3-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-(3-methoxypropyl)-3-quinolinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-(3-methoxypropyl)quinoline-3-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-N-(3-methoxypropyl)quinoline-3-carboxamide Formula: C23H23ClN4O3 MolecularWeight: 438.90672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClN4O3/c1-30-9-3-8-26-23(29)18-14-27-20-6-4-15(12-25)10-17(20)22(18)28-13-16-5-7-21(31-2)19(24)11-16/h4-7,10-11,14H,3,8-9,13H2,1-2H3,(H,26,29)(H,27,28)