N-(5-chloranyl-2-methyl-phenyl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[4-[(E)-cinnamyl]piperazin-1-yl]propanamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]propanamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]propanamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-[4-[(E)-cinnamyl]piperazino]propionamide Formula: C23H28ClN3O MolecularWeight: 397.94092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)C(C)N2CCN(CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H28ClN3O/c1-18-10-11-21(24)17-22(18)25-23(28)19(2)27-15-13-26(14-16-27)12-6-9-20-7-4-3-5-8-20/h3-11,17,19H,12-16H2,1-2H3,(H,25,28)/b9-6+