2-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide

Systemtic Name: 2-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide Openeye Name: 2-[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]-N-(m-tolylmethyl)propanamide CAS Name: 2-[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]-N-[(3-methylphenyl)methyl]propanamide IUPAC Name: 2-[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]-N-[(3-methylphenyl)methyl]propanamide Traditional Name: 2-[4-(5-chloro-2-methoxy-phenyl)piperazino]-N-(3-methylbenzyl)propionamide Formula: C22H28ClN3O2 MolecularWeight: 401.92962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClN3O2/c1-16-5-4-6-18(13-16)15-24-22(27)17(2)25-9-11-26(12-10-25)20-14-19(23)7-8-21(20)28-3/h4-8,13-14,17H,9-12,15H2,1-3H3,(H,24,27)