N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-2-(4-tert-butylphenoxy)-2-methyl-propanamide

Systemtic Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-2-(4-tert-butylphenoxy)-2-methyl-propanamide Openeye Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloro-phenyl]-2-(4-tert-butylphenoxy)-2-methyl-propanamide CAS Name: 2-(4-tert-butylphenoxy)-N-[3-chloro-4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-2-methylpropanamide IUPAC Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]-2-(4-tert-butylphenoxy)-2-methylpropanamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[4-(4-butyrylpiperazino)-3-chloro-phenyl]-2-methyl-propionamide Formula: C28H38ClN3O3 MolecularWeight: 500.07262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38ClN3O3/c1-7-8-25(33)32-17-15-31(16-18-32)24-14-11-21(19-23(24)29)30-26(34)28(5,6)35-22-12-9-20(10-13-22)27(2,3)4/h9-14,19H,7-8,15-18H2,1-6H3,(H,30,34)