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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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