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

Systemtic Name: N-[2-[[(2-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]-4-nitro-benzamide Openeye Name: N-[2-[[(2-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]-4-nitro-benzamide CAS Name: N-[2-[[(2-aminocyclohexyl)-(3,3-dimethyl-1-oxobutyl)amino]methyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[2-[[(2-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]-4-nitrobenzamide Traditional Name: N-[2-[[(2-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]phenyl]-4-nitro-benzamide Formula: C26H34N4O4 MolecularWeight: 466.57256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3CCCCC3N

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3CCCCC3N

InChI

InChI=1S/C26H34N4O4/c1-26(2,3)16-24(31)29(23-11-7-5-9-21(23)27)17-19-8-4-6-10-22(19)28-25(32)18-12-14-20(15-13-18)30(33)34/h4,6,8,10,12-15,21,23H,5,7,9,11,16-17,27H2,1-3H3,(H,28,32)