N4-(3-chloranyl-4-methyl-phenyl)-N1-cyclohexyl-isoquinoline-1,4-dicarboxamide

Systemtic Name: N4-(3-chloranyl-4-methyl-phenyl)-N1-cyclohexyl-isoquinoline-1,4-dicarboxamide Openeye Name: N4-(3-chloro-4-methyl-phenyl)-N1-cyclohexyl-isoquinoline-1,4-dicarboxamide CAS Name: N4-(3-chloro-4-methylphenyl)-N1-cyclohexylisoquinoline-1,4-dicarboxamide IUPAC Name: 4-N-(3-chloro-4-methylphenyl)-1-N-cyclohexylisoquinoline-1,4-dicarboxamide Traditional Name: N'-(3-chloro-4-methyl-phenyl)-N-cyclohexyl-isoquinoline-1,4-dicarboxamide Formula: C24H24ClN3O2 MolecularWeight: 421.91926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CN=C(C3=CC=CC=C32)C(=O)NC4CCCCC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CN=C(C3=CC=CC=C32)C(=O)NC4CCCCC4)Cl

InChI

InChI=1S/C24H24ClN3O2/c1-15-11-12-17(13-21(15)25)28-23(29)20-14-26-22(19-10-6-5-9-18(19)20)24(30)27-16-7-3-2-4-8-16/h5-6,9-14,16H,2-4,7-8H2,1H3,(H,27,30)(H,28,29)