(2R)-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-ium-1-yl]-N-phenyl-propanamide

Systemtic Name: (2R)-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-ium-1-yl]-N-phenyl-propanamide Openeye Name: (2R)-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazin-1-ium-1-yl]-N-phenyl-propanamide CAS Name: (2R)-2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazin-1-iumyl]-N-phenylpropanamide IUPAC Name: (2R)-2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazin-1-ium-1-yl]-N-phenylpropanamide Traditional Name: (2R)-2-[4-(4,5-dimethoxy-2-methyl-benzyl)piperazin-1-ium-1-yl]-N-phenyl-propionamide Formula: C23H32N3O3+ MolecularWeight: 398.51848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CC[NH+](CC2)C(C)C(=O)NC3=CC=CC=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CC[NH+](CC2)[C@H](C)C(=O)NC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C23H31N3O3/c1-17-14-21(28-3)22(29-4)15-19(17)16-25-10-12-26(13-11-25)18(2)23(27)24-20-8-6-5-7-9-20/h5-9,14-15,18H,10-13,16H2,1-4H3,(H,24,27)/p+1/t18-/m1/s1