N-(1-ethylpiperidin-1-ium-4-yl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide

Systemtic Name: N-(1-ethylpiperidin-1-ium-4-yl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide Openeye Name: N-(1-ethylpiperidin-1-ium-4-yl)-4-[[(E)-styryl]sulfonylamino]benzamide CAS Name: N-(1-ethyl-4-piperidin-1-iumyl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide IUPAC Name: N-(1-ethylpiperidin-1-ium-4-yl)-4-[[(E)-2-phenylethenyl]sulfonylamino]benzamide Traditional Name: N-(1-ethylpiperidin-1-ium-4-yl)-4-[[(E)-styryl]sulfonylamino]benzamide Formula: C22H28N3O3S+ MolecularWeight: 414.54102

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3S/c1-2-25-15-12-20(13-16-25)23-22(26)19-8-10-21(11-9-19)24-29(27,28)17-14-18-6-4-3-5-7-18/h3-11,14,17,20,24H,2,12-13,15-16H2,1H3,(H,23,26)/p+1/b17-14+