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

Systemtic Name: 2-[4-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-[2-[(2S)-2-ethyl-1-piperidyl]-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[2-[(2S)-2-ethyl-1-piperidinyl]-2-oxoethyl]-1-piperazin-1-iumyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-benzyl-2-[4-[2-[(2S)-2-ethylpiperidino]-2-keto-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C22H35N4O2+ MolecularWeight: 387.5389

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CN2CC[NH+](CC2)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)CN2CC[NH+](CC2)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H34N4O2/c1-2-20-10-6-7-11-26(20)22(28)18-25-14-12-24(13-15-25)17-21(27)23-16-19-8-4-3-5-9-19/h3-5,8-9,20H,2,6-7,10-18H2,1H3,(H,23,27)/p+1/t20-/m0/s1