3-chloranyl-N-(2-methoxyethyl)-4-[1-[(3-methylthiophen-2-yl)methyl]piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: 3-chloranyl-N-(2-methoxyethyl)-4-[1-[(3-methylthiophen-2-yl)methyl]piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: 3-chloro-N-(2-methoxyethyl)-4-[1-[(3-methyl-2-thienyl)methyl]piperidin-1-ium-4-yl]oxy-benzamide CAS Name: 3-chloro-N-(2-methoxyethyl)-4-[[1-[(3-methyl-2-thiophenyl)methyl]-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: 3-chloro-N-(2-methoxyethyl)-4-[1-[(3-methylthiophen-2-yl)methyl]piperidin-1-ium-4-yl]oxybenzamide Traditional Name: 3-chloro-N-(2-methoxyethyl)-4-[1-[(3-methyl-2-thienyl)methyl]piperidin-1-ium-4-yl]oxy-benzamide Formula: C21H28ClN2O3S+ MolecularWeight: 423.97662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+]2CCC(CC2)OC3=C(C=C(C=C3)C(=O)NCCOC)Cl

Isomeric SMILES

CC1=C(SC=C1)C[NH+]2CCC(CC2)OC3=C(C=C(C=C3)C(=O)NCCOC)Cl

InChI

InChI=1S/C21H27ClN2O3S/c1-15-7-12-28-20(15)14-24-9-5-17(6-10-24)27-19-4-3-16(13-18(19)22)21(25)23-8-11-26-2/h3-4,7,12-13,17H,5-6,8-11,14H2,1-2H3,(H,23,25)/p+1