N-[3-[[(2-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]-4-chloranyl-phenyl]cyclohexanecarboxamide

Systemtic Name: N-[3-[[(2-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]-4-chloranyl-phenyl]cyclohexanecarboxamide Openeye Name: N-[3-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]-4-chloro-phenyl]cyclohexanecarboxamide CAS Name: N-[3-[[(2-aminocyclohexyl)-[cyclohexyl(oxo)methyl]amino]methyl]-4-chlorophenyl]cyclohexanecarboxamide IUPAC Name: N-[3-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]-4-chlorophenyl]cyclohexanecarboxamide Traditional Name: N-[3-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]-4-chloro-phenyl]cyclohexanecarboxamide Formula: C27H40ClN3O2 MolecularWeight: 474.0784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC(=C(C=C2)Cl)CN(C3CCCCC3N)C(=O)C4CCCCC4

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC(=C(C=C2)Cl)CN(C3CCCCC3N)C(=O)C4CCCCC4

InChI

InChI=1S/C27H40ClN3O2/c28-23-16-15-22(30-26(32)19-9-3-1-4-10-19)17-21(23)18-31(25-14-8-7-13-24(25)29)27(33)20-11-5-2-6-12-20/h15-17,19-20,24-25H,1-14,18,29H2,(H,30,32)