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

Systemtic Name: N-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-quinolin-3-yl]cyclohexanecarboxamide Openeye Name: N-[4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-3-quinolyl]cyclohexanecarboxamide CAS Name: N-[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-3-quinolinyl]cyclohexanecarboxamide IUPAC Name: N-[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyanoquinolin-3-yl]cyclohexanecarboxamide Traditional Name: N-[4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-3-quinolyl]cyclohexanecarboxamide Formula: C25H25ClN4O2 MolecularWeight: 448.9446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2NC(=O)C4CCCCC4)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C3C=C(C=CC3=NC=C2NC(=O)C4CCCCC4)C#N)Cl

InChI

InChI=1S/C25H25ClN4O2/c1-32-23-10-8-17(12-20(23)26)14-29-24-19-11-16(13-27)7-9-21(19)28-15-22(24)30-25(31)18-5-3-2-4-6-18/h7-12,15,18H,2-6,14H2,1H3,(H,28,29)(H,30,31)