N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-methyl-2-phenoxy-propanamide

Systemtic Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-methyl-2-phenoxy-propanamide Openeye Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-methyl-2-phenoxy-propanamide CAS Name: 2-methyl-N-[4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-2-phenoxypropanamide IUPAC Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-2-methyl-2-phenoxypropanamide Traditional Name: N-[4-(4-butyrylpiperazino)phenyl]-2-methyl-2-phenoxy-propionamide Formula: C24H31N3O3 MolecularWeight: 409.52124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C(C)(C)OC3=CC=CC=C3

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C(C)(C)OC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O3/c1-4-8-22(28)27-17-15-26(16-18-27)20-13-11-19(12-14-20)25-23(29)24(2,3)30-21-9-6-5-7-10-21/h5-7,9-14H,4,8,15-18H2,1-3H3,(H,25,29)