N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-methyl-benzamide

Systemtic Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-methyl-benzamide Openeye Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: N-[4-(4-butanoylpiperazin-1-yl)phenyl]-3-methylbenzamide Traditional Name: N-[4-(4-butyrylpiperazino)phenyl]-3-methyl-benzamide Formula: C22H27N3O2 MolecularWeight: 365.46868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2/c1-3-5-21(26)25-14-12-24(13-15-25)20-10-8-19(9-11-20)23-22(27)18-7-4-6-17(2)16-18/h4,6-11,16H,3,5,12-15H2,1-2H3,(H,23,27)