4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N-(2-hydroxyethyl)-N-propyl-quinoline-3-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N-(2-hydroxyethyl)-N-propyl-quinoline-3-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-N-(2-hydroxyethyl)-N-propyl-quinoline-3-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-(2-hydroxyethyl)-N-propyl-3-quinolinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-(2-hydroxyethyl)-N-propylquinoline-3-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-N-(2-hydroxyethyl)-N-propyl-quinoline-3-carboxamide Formula: C24H25ClN4O3 MolecularWeight: 452.9333

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25ClN4O3/c1-3-8-29(9-10-30)24(31)19-15-27-21-6-4-16(13-26)11-18(21)23(19)28-14-17-5-7-22(32-2)20(25)12-17/h4-7,11-12,15,30H,3,8-10,14H2,1-2H3,(H,27,28)