3-(3-chloranyl-4-methyl-phenyl)-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]propanamide

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]propanamide Openeye Name: 3-(3-chloro-4-methyl-phenyl)-N-[4-(3-oxopiperazin-1-yl)phenyl]propanamide CAS Name: 3-(3-chloro-4-methylphenyl)-N-[4-(3-oxo-1-piperazinyl)phenyl]propanamide IUPAC Name: 3-(3-chloro-4-methylphenyl)-N-[4-(3-oxopiperazin-1-yl)phenyl]propanamide Traditional Name: 3-(3-chloro-4-methyl-phenyl)-N-[4-(3-ketopiperazino)phenyl]propionamide Formula: C20H22ClN3O2 MolecularWeight: 371.86058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)NC2=CC=C(C=C2)N3CCNC(=O)C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)NC2=CC=C(C=C2)N3CCNC(=O)C3)Cl

InChI

InChI=1S/C20H22ClN3O2/c1-14-2-3-15(12-18(14)21)4-9-19(25)23-16-5-7-17(8-6-16)24-11-10-22-20(26)13-24/h2-3,5-8,12H,4,9-11,13H2,1H3,(H,22,26)(H,23,25)