N-(2-azanylcyclohexyl)-N-[[4-(3,3-dimethylbutanoylamino)phenyl]methyl]cyclohexanecarboxamide

Systemtic Name: N-(2-azanylcyclohexyl)-N-[[4-(3,3-dimethylbutanoylamino)phenyl]methyl]cyclohexanecarboxamide Openeye Name: N-(2-aminocyclohexyl)-N-[[4-(3,3-dimethylbutanoylamino)phenyl]methyl]cyclohexanecarboxamide CAS Name: N-(2-aminocyclohexyl)-N-[[4-[(3,3-dimethyl-1-oxobutyl)amino]phenyl]methyl]cyclohexanecarboxamide IUPAC Name: N-(2-aminocyclohexyl)-N-[[4-(3,3-dimethylbutanoylamino)phenyl]methyl]cyclohexanecarboxamide Traditional Name: N-(2-aminocyclohexyl)-N-[4-(3,3-dimethylbutanoylamino)benzyl]cyclohexanecarboxamide Formula: C26H41N3O2 MolecularWeight: 427.62264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC=C(C=C1)CN(C2CCCCC2N)C(=O)C3CCCCC3

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC=C(C=C1)CN(C2CCCCC2N)C(=O)C3CCCCC3

InChI

InChI=1S/C26H41N3O2/c1-26(2,3)17-24(30)28-21-15-13-19(14-16-21)18-29(23-12-8-7-11-22(23)27)25(31)20-9-5-4-6-10-20/h13-16,20,22-23H,4-12,17-18,27H2,1-3H3,(H,28,30)