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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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