N4-(7-chloranylquinolin-4-yl)-N1-[(4-phenylmethoxyphenyl)methyl]cyclohexane-1,4-diamine

Systemtic Name: N4-(7-chloranylquinolin-4-yl)-N1-[(4-phenylmethoxyphenyl)methyl]cyclohexane-1,4-diamine Openeye Name: N1-[(4-benzyloxyphenyl)methyl]-N4-(7-chloro-4-quinolyl)cyclohexane-1,4-diamine CAS Name: N4-(7-chloro-4-quinolinyl)-N1-[(4-phenylmethoxyphenyl)methyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-(7-chloroquinolin-4-yl)-1-N-[(4-phenylmethoxyphenyl)methyl]cyclohexane-1,4-diamine Traditional Name: (4-benzoxybenzyl)-[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]amine Formula: C29H30ClN3O MolecularWeight: 472.021

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NCC2=CC=C(C=C2)OCC3=CC=CC=C3)NC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

C1CC(CCC1NCC2=CC=C(C=C2)OCC3=CC=CC=C3)NC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C29H30ClN3O/c30-23-8-15-27-28(16-17-31-29(27)18-23)33-25-11-9-24(10-12-25)32-19-21-6-13-26(14-7-21)34-20-22-4-2-1-3-5-22/h1-8,13-18,24-25,32H,9-12,19-20H2,(H,31,33)