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

Systemtic Name: N-[3-[[(4-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclopentanecarboxamide Openeye Name: N-[3-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclopentanecarboxamide CAS Name: N-[3-[[(4-aminocyclohexyl)-(3,3-dimethyl-1-oxobutyl)amino]methyl]phenyl]cyclopentanecarboxamide IUPAC Name: N-[3-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclopentanecarboxamide Traditional Name: N-[3-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclopentanecarboxamide Formula: C25H39N3O2 MolecularWeight: 413.59606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CC1=CC(=CC=C1)NC(=O)C2CCCC2)C3CCC(CC3)N

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC(=CC=C1)NC(=O)C2CCCC2)C3CCC(CC3)N

InChI

InChI=1S/C25H39N3O2/c1-25(2,3)16-23(29)28(22-13-11-20(26)12-14-22)17-18-7-6-10-21(15-18)27-24(30)19-8-4-5-9-19/h6-7,10,15,19-20,22H,4-5,8-9,11-14,16-17,26H2,1-3H3,(H,27,30)