N-methyl-2-[(2S)-1-(naphthalen-1-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[2-(oxan-4-yl)ethyl]ethanamide

Systemtic Name: N-methyl-2-[(2S)-1-(naphthalen-1-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-[2-(oxan-4-yl)ethyl]ethanamide Openeye Name: N-methyl-2-[(2S)-1-(1-naphthylmethyl)-3-oxo-piperazin-1-ium-2-yl]-N-(2-tetrahydropyran-4-ylethyl)acetamide CAS Name: N-methyl-2-[(2S)-1-(1-naphthalenylmethyl)-3-oxo-2-piperazin-1-iumyl]-N-[2-(4-oxanyl)ethyl]acetamide IUPAC Name: N-methyl-2-[(2S)-1-(naphthalen-1-ylmethyl)-3-oxopiperazin-1-ium-2-yl]-N-[2-(oxan-4-yl)ethyl]acetamide Traditional Name: 2-[(2S)-3-keto-1-(1-naphthylmethyl)piperazin-1-ium-2-yl]-N-methyl-N-(2-tetrahydropyran-4-ylethyl)acetamide Formula: C25H34N3O3+ MolecularWeight: 424.55576

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1CCOCC1)C(=O)CC2C(=O)NCC[NH+]2CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN(CCC1CCOCC1)C(=O)C[C@H]2C(=O)NCC[NH+]2CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H33N3O3/c1-27(13-9-19-10-15-31-16-11-19)24(29)17-23-25(30)26-12-14-28(23)18-21-7-4-6-20-5-2-3-8-22(20)21/h2-8,19,23H,9-18H2,1H3,(H,26,30)/p+1/t23-/m0/s1