(2S)-N-(3-methoxyphenyl)-2-phenyl-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: (2S)-N-(3-methoxyphenyl)-2-phenyl-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: (2S)-N-(3-methoxyphenyl)-2-phenyl-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: (2S)-N-(3-methoxyphenyl)-2-phenyl-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: (2S)-N-(3-methoxyphenyl)-2-phenyl-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: (2S)-N-(3-methoxyphenyl)-2-phenyl-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C25H28N3O2+ MolecularWeight: 402.50872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C(C2=CC=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)[C@H](C2=CC=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O2/c1-30-23-14-8-11-21(19-23)26-25(29)24(20-9-4-2-5-10-20)28-17-15-27(16-18-28)22-12-6-3-7-13-22/h2-14,19,24H,15-18H2,1H3,(H,26,29)/p+1/t24-/m0/s1