4-[2-[(2S)-1-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-2-yl]ethyl]morpholin-4-ium

Systemtic Name: 4-[2-[(2S)-1-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-2-yl]ethyl]morpholin-4-ium Openeye Name: 4-[2-[(2S)-1-[[5-(1-naphthyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-2-yl]ethyl]morpholin-4-ium CAS Name: 4-[2-[(2S)-1-[[5-(1-naphthalenyl)-1H-pyrazol-4-yl]methyl]-2-piperidin-1-iumyl]ethyl]morpholin-4-ium IUPAC Name: 4-[2-[(2S)-1-[(5-naphthalen-1-yl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-2-yl]ethyl]morpholin-4-ium Traditional Name: 4-[2-[(2S)-1-[[5-(1-naphthyl)-1H-pyrazol-4-yl]methyl]piperidin-1-ium-2-yl]ethyl]morpholin-4-ium Formula: C25H34N4O+2 MolecularWeight: 406.56366

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)CC[NH+]2CCOCC2)CC3=C(NN=C3)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CC[NH+]([C@@H](C1)CC[NH+]2CCOCC2)CC3=C(NN=C3)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H32N4O/c1-2-9-23-20(6-1)7-5-10-24(23)25-21(18-26-27-25)19-29-12-4-3-8-22(29)11-13-28-14-16-30-17-15-28/h1-2,5-7,9-10,18,22H,3-4,8,11-17,19H2,(H,26,27)/p+2/t22-/m0/s1