N-[4-[[(4-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclohexanecarboxamide Openeye Name: N-[4-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclohexanecarboxamide CAS Name: N-[4-[[(4-aminocyclohexyl)-(3,3-dimethyl-1-oxobutyl)amino]methyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclohexanecarboxamide Formula: C26H41N3O2 MolecularWeight: 427.62264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2CCCCC2)C3CCC(CC3)N

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2CCCCC2)C3CCC(CC3)N

InChI

InChI=1S/C26H41N3O2/c1-26(2,3)17-24(30)29(23-15-11-21(27)12-16-23)18-19-9-13-22(14-10-19)28-25(31)20-7-5-4-6-8-20/h9-10,13-14,20-21,23H,4-8,11-12,15-18,27H2,1-3H3,(H,28,31)