N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3-phenyl-propanamide

Systemtic Name: N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3-phenyl-propanamide Openeye Name: N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3-phenyl-propanamide CAS Name: N-[(2S)-2-(4-methoxyphenyl)-2-(4-methyl-1-piperazin-4-iumyl)ethyl]-3-phenylpropanamide IUPAC Name: N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3-phenylpropanamide Traditional Name: N-[(2S)-2-(4-methoxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3-phenyl-propionamide Formula: C23H32N3O2+ MolecularWeight: 382.51908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(CNC(=O)CCC2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+]1CCN(CC1)[C@H](CNC(=O)CCC2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H31N3O2/c1-25-14-16-26(17-15-25)22(20-9-11-21(28-2)12-10-20)18-24-23(27)13-8-19-6-4-3-5-7-19/h3-7,9-12,22H,8,13-18H2,1-2H3,(H,24,27)/p+1/t22-/m1/s1