N-[4-[[(2-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclopentanecarboxamide

Systemtic Name: N-[4-[[(2-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclopentanecarboxamide Openeye Name: N-[4-[[(2-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclopentanecarboxamide CAS Name: N-[4-[[(2-aminocyclohexyl)-(3,3-dimethyl-1-oxobutyl)amino]methyl]phenyl]cyclopentanecarboxamide IUPAC Name: N-[4-[[(2-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]cyclopentanecarboxamide Traditional Name: N-[4-[[(2-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=C(C=C1)NC(=O)C2CCCC2)C3CCCCC3N

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC=C(C=C1)NC(=O)C2CCCC2)C3CCCCC3N

InChI

InChI=1S/C25H39N3O2/c1-25(2,3)16-23(29)28(22-11-7-6-10-21(22)26)17-18-12-14-20(15-13-18)27-24(30)19-8-4-5-9-19/h12-15,19,21-22H,4-11,16-17,26H2,1-3H3,(H,27,30)