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

Systemtic Name: N-[2-[[(2-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]phenyl]cyclohexanecarboxamide Openeye Name: N-[2-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]cyclohexanecarboxamide CAS Name: N-[2-[[(2-aminocyclohexyl)-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[2-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]cyclohexanecarboxamide Traditional Name: N-[2-[[(2-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]cyclohexanecarboxamide Formula: C27H41N3O2 MolecularWeight: 439.63334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=CC=C2CN(C3CCCCC3N)C(=O)C4CCCCC4

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=CC=C2CN(C3CCCCC3N)C(=O)C4CCCCC4

InChI

InChI=1S/C27H41N3O2/c28-23-16-8-10-18-25(23)30(27(32)21-13-5-2-6-14-21)19-22-15-7-9-17-24(22)29-26(31)20-11-3-1-4-12-20/h7,9,15,17,20-21,23,25H,1-6,8,10-14,16,18-19,28H2,(H,29,31)