N-(2-ethylphenyl)-2-[(5-piperidin-1-ylsulfonylpyridin-1-ium-2-yl)amino]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[(5-piperidin-1-ylsulfonylpyridin-1-ium-2-yl)amino]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[[5-(1-piperidylsulfonyl)pyridin-1-ium-2-yl]amino]acetamide CAS Name: N-(2-ethylphenyl)-2-[[5-(1-piperidinylsulfonyl)-2-pyridin-1-iumyl]amino]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[(5-piperidin-1-ylsulfonylpyridin-1-ium-2-yl)amino]acetamide Traditional Name: N-(2-ethylphenyl)-2-[(5-piperidinosulfonylpyridin-1-ium-2-yl)amino]acetamide Formula: C20H27N4O3S+ MolecularWeight: 403.51838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC2=[NH+]C=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC2=[NH+]C=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H26N4O3S/c1-2-16-8-4-5-9-18(16)23-20(25)15-22-19-11-10-17(14-21-19)28(26,27)24-12-6-3-7-13-24/h4-5,8-11,14H,2-3,6-7,12-13,15H2,1H3,(H,21,22)(H,23,25)/p+1