2-chloranyl-N-[4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]phenyl]-4-methyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]phenyl]-4-methyl-benzamide Openeye Name: 2-chloro-N-[4-[4-(4-ethylbenzoyl)piperazin-1-yl]phenyl]-4-methyl-benzamide CAS Name: 2-chloro-N-[4-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-4-methylbenzamide IUPAC Name: 2-chloro-N-[4-[4-(4-ethylbenzoyl)piperazin-1-yl]phenyl]-4-methylbenzamide Traditional Name: 2-chloro-N-[4-[4-(4-ethylbenzoyl)piperazino]phenyl]-4-methyl-benzamide Formula: C27H28ClN3O2 MolecularWeight: 461.98312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=C(C=C(C=C4)C)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=C(C=C(C=C4)C)Cl

InChI

InChI=1S/C27H28ClN3O2/c1-3-20-5-7-21(8-6-20)27(33)31-16-14-30(15-17-31)23-11-9-22(10-12-23)29-26(32)24-13-4-19(2)18-25(24)28/h4-13,18H,3,14-17H2,1-2H3,(H,29,32)