2-methyl-N-[3-(2,4,4-trimethylpentan-2-ylcarbamoylamino)phenyl]pentanamide

Systemtic Name: 2-methyl-N-[3-(2,4,4-trimethylpentan-2-ylcarbamoylamino)phenyl]pentanamide Openeye Name: 2-methyl-N-[3-(1,1,3,3-tetramethylbutylcarbamoylamino)phenyl]pentanamide CAS Name: 2-methyl-N-[3-[[oxo-(2,4,4-trimethylpentan-2-ylamino)methyl]amino]phenyl]pentanamide IUPAC Name: 2-methyl-N-[3-(2,4,4-trimethylpentan-2-ylcarbamoylamino)phenyl]pentanamide Traditional Name: 2-methyl-N-[3-(1,1,3,3-tetramethylbutylcarbamoylamino)phenyl]valeramide Formula: C21H35N3O2 MolecularWeight: 361.5215

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)NC1=CC(=CC=C1)NC(=O)NC(C)(C)CC(C)(C)C

Isomeric SMILES

CCCC(C)C(=O)NC1=CC(=CC=C1)NC(=O)NC(C)(C)CC(C)(C)C

InChI

InChI=1S/C21H35N3O2/c1-8-10-15(2)18(25)22-16-11-9-12-17(13-16)23-19(26)24-21(6,7)14-20(3,4)5/h9,11-13,15H,8,10,14H2,1-7H3,(H,22,25)(H2,23,24,26)