1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone Openeye Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone CAS Name: 1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-(3,4,5-trimethoxyphenyl)ethanone IUPAC Name: 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-(3,4,5-trimethoxyphenyl)ethanone Traditional Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazino]-2-(3,4,5-trimethoxyphenyl)ethanone Formula: C22H27ClN2O4 MolecularWeight: 418.91378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C22H27ClN2O4/c1-15-5-6-17(23)14-18(15)24-7-9-25(10-8-24)21(26)13-16-11-19(27-2)22(29-4)20(12-16)28-3/h5-6,11-12,14H,7-10,13H2,1-4H3