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

Systemtic Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]-3-ethoxy-benzamide Openeye Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chloro-phenyl]-3-ethoxy-benzamide CAS Name: N-[3-chloro-4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-3-ethoxybenzamide IUPAC Name: N-[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]-3-ethoxybenzamide Traditional Name: N-[4-(4-butyrylpiperazino)-3-chloro-phenyl]-3-ethoxy-benzamide Formula: C23H28ClN3O3 MolecularWeight: 429.93972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28ClN3O3/c1-3-6-22(28)27-13-11-26(12-14-27)21-10-9-18(16-20(21)24)25-23(29)17-7-5-8-19(15-17)30-4-2/h5,7-10,15-16H,3-4,6,11-14H2,1-2H3,(H,25,29)