2-naphthalen-1-yl-N-[(2S)-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]propan-2-yl]ethanamide

Systemtic Name: 2-naphthalen-1-yl-N-[(2S)-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]propan-2-yl]ethanamide Openeye Name: N-[(1S)-2-(4-benzylpiperazin-4-ium-1-yl)-1-methyl-2-oxo-ethyl]-2-(1-naphthyl)acetamide CAS Name: 2-(1-naphthalenyl)-N-[(2S)-1-oxo-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]propan-2-yl]acetamide IUPAC Name: N-[(2S)-1-(4-benzylpiperazin-4-ium-1-yl)-1-oxopropan-2-yl]-2-naphthalen-1-ylacetamide Traditional Name: N-[(1S)-2-(4-benzylpiperazin-4-ium-1-yl)-2-keto-1-methyl-ethyl]-2-(1-naphthyl)acetamide Formula: C26H30N3O2+ MolecularWeight: 416.5353

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC[NH+](CC1)CC2=CC=CC=C2)NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[C@@H](C(=O)N1CC[NH+](CC1)CC2=CC=CC=C2)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H29N3O2/c1-20(27-25(30)18-23-12-7-11-22-10-5-6-13-24(22)23)26(31)29-16-14-28(15-17-29)19-21-8-3-2-4-9-21/h2-13,20H,14-19H2,1H3,(H,27,30)/p+1/t20-/m0/s1