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

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N-methyl-N-propyl-quinoline-3-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-N-methyl-N-propyl-quinoline-3-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-methyl-N-propyl-3-quinolinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-methyl-N-propylquinoline-3-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-N-methyl-N-propyl-quinoline-3-carboxamide Formula: C23H23ClN4O2 MolecularWeight: 422.90732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClN4O2/c1-4-9-28(2)23(29)18-14-26-20-7-5-15(12-25)10-17(20)22(18)27-13-16-6-8-21(30-3)19(24)11-16/h5-8,10-11,14H,4,9,13H2,1-3H3,(H,26,27)