N-[[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-quinolin-3-yl]methyl]cyclohexanecarboxamide

Systemtic Name: N-[[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-quinolin-3-yl]methyl]cyclohexanecarboxamide Openeye Name: N-[[4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-3-quinolyl]methyl]cyclohexanecarboxamide CAS Name: N-[[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-3-quinolinyl]methyl]cyclohexanecarboxamide IUPAC Name: N-[[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyanoquinolin-3-yl]methyl]cyclohexanecarboxamide Traditional Name: N-[[4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-3-quinolyl]methyl]cyclohexanecarboxamide Formula: C26H27ClN4O2 MolecularWeight: 462.97118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2CNC(=O)C4CCCCC4)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2CNC(=O)C4CCCCC4)C#N)Cl

InChI

InChI=1S/C26H27ClN4O2/c1-33-24-10-8-18(12-22(24)27)14-30-25-20(16-31-26(32)19-5-3-2-4-6-19)15-29-23-9-7-17(13-28)11-21(23)25/h7-12,15,19H,2-6,14,16H2,1H3,(H,29,30)(H,31,32)