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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NCCCN2CC[NH+](CC2C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NCCCN2CC[NH+](C[C@@H]2C3=CC=CC=C3)C

InChI

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