(2S)-N-(2,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-propanamide

Systemtic Name: (2S)-N-(2,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-propanamide Openeye Name: (2S)-N-(2,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-propanamide CAS Name: (2S)-N-(2,4-dimethoxyphenyl)-2-(1-piperazin-4-iumyl)propanamide IUPAC Name: (2S)-N-(2,4-dimethoxyphenyl)-2-piperazin-4-ium-1-ylpropanamide Traditional Name: (2S)-N-(2,4-dimethoxyphenyl)-2-piperazin-4-ium-1-yl-propionamide Formula: C15H24N3O3+ MolecularWeight: 294.36936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)OC)OC)N2CC[NH2+]CC2

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(C=C1)OC)OC)N2CC[NH2+]CC2

InChI

InChI=1S/C15H23N3O3/c1-11(18-8-6-16-7-9-18)15(19)17-13-5-4-12(20-2)10-14(13)21-3/h4-5,10-11,16H,6-9H2,1-3H3,(H,17,19)/p+1/t11-/m0/s1