N-(2-ethylphenyl)-2-[4-[[(2R)-oxan-2-yl]methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-[[(2R)-oxan-2-yl]methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-[[(2R)-tetrahydropyran-2-yl]methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[[(2R)-2-oxanyl]methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-[[(2R)-oxan-2-yl]methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[4-[[(2R)-tetrahydropyran-2-yl]methyl]piperazine-1,4-diium-1-yl]acetamide Formula: C20H33N3O2+2 MolecularWeight: 347.49492

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CC[NH+](CC2)CC3CCCCO3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CC[NH+](CC2)C[C@H]3CCCCO3

InChI

InChI=1S/C20H31N3O2/c1-2-17-7-3-4-9-19(17)21-20(24)16-23-12-10-22(11-13-23)15-18-8-5-6-14-25-18/h3-4,7,9,18H,2,5-6,8,10-16H2,1H3,(H,21,24)/p+2/t18-/m1/s1