(2S)-N-[3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propyl]-2-phenoxy-propanamide

Systemtic Name: (2S)-N-[3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propyl]-2-phenoxy-propanamide Openeye Name: (2S)-N-[3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propyl]-2-phenoxy-propanamide CAS Name: (2S)-N-[3-[(2S)-4-methyl-2-phenyl-1-piperazin-4-iumyl]propyl]-2-phenoxypropanamide IUPAC Name: (2S)-N-[3-[(2S)-4-methyl-2-phenylpiperazin-4-ium-1-yl]propyl]-2-phenoxypropanamide Traditional Name: (2S)-N-[3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propyl]-2-phenoxy-propionamide Formula: C23H32N3O2+ MolecularWeight: 382.51908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCN1CC[NH+](CC1C2=CC=CC=C2)C)OC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NCCCN1CC[NH+](C[C@@H]1C2=CC=CC=C2)C)OC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O2/c1-19(28-21-12-7-4-8-13-21)23(27)24-14-9-15-26-17-16-25(2)18-22(26)20-10-5-3-6-11-20/h3-8,10-13,19,22H,9,14-18H2,1-2H3,(H,24,27)/p+1/t19-,22+/m0/s1