5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1-ethylpiperidin-1-ium-4-yl)thiophene-2-carboxamide

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1-ethylpiperidin-1-ium-4-yl)thiophene-2-carboxamide Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1-ethylpiperidin-1-ium-4-yl)thiophene-2-carboxamide CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1-ethyl-4-piperidin-1-iumyl)-2-thiophenecarboxamide IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1-ethylpiperidin-1-ium-4-yl)thiophene-2-carboxamide Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(1-ethylpiperidin-1-ium-4-yl)thiophene-2-carboxamide Formula: C20H25N2O3S+ MolecularWeight: 373.4891

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)C2=CC=C(S2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)C2=CC=C(S2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H24N2O3S/c1-2-22-9-7-15(8-10-22)21-20(23)19-6-5-18(26-19)14-3-4-16-17(13-14)25-12-11-24-16/h3-6,13,15H,2,7-12H2,1H3,(H,21,23)/p+1