N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperidin-1-ium-1-yl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperidin-1-ium-1-yl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperidin-1-ium-1-yl)-N-(2-thienylmethyl)acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methyl-1-piperidin-1-iumyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperidin-1-ium-1-yl)-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-methylpiperidin-1-ium-1-yl)-N-(2-thenyl)acetamide Formula: C21H27N2O3S+ MolecularWeight: 387.51568

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1CC[NH+](CC1)CC(=O)N(CC2=CC=CS2)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H26N2O3S/c1-16-6-8-22(9-7-16)15-21(24)23(14-18-3-2-12-27-18)17-4-5-19-20(13-17)26-11-10-25-19/h2-5,12-13,16H,6-11,14-15H2,1H3/p+1