4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-8-ethyl-quinoline-3-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-8-ethyl-quinoline-3-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-8-ethyl-quinoline-3-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-8-ethyl-3-quinolinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-8-ethylquinoline-3-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-8-ethyl-quinoline-3-carboxamide Formula: C21H19ClN4O2 MolecularWeight: 394.85416

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC2=C(C(=CN=C12)C(=O)N)NCC3=CC(=C(C=C3)OC)Cl)C#N

Isomeric SMILES

CCC1=CC(=CC2=C(C(=CN=C12)C(=O)N)NCC3=CC(=C(C=C3)OC)Cl)C#N

InChI

InChI=1S/C21H19ClN4O2/c1-3-14-6-13(9-23)7-15-19(14)26-11-16(21(24)27)20(15)25-10-12-4-5-18(28-2)17(22)8-12/h4-8,11H,3,10H2,1-2H3,(H2,24,27)(H,25,26)