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

Systemtic Name: 3-chloranyl-N-(2-methoxyethyl)-4-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: 3-chloro-N-(2-methoxyethyl)-4-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-benzamide CAS Name: 3-chloro-N-(2-methoxyethyl)-4-[[1-[(1-methyl-4-pyrazolyl)methyl]-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: 3-chloro-N-(2-methoxyethyl)-4-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxybenzamide Traditional Name: 3-chloro-N-(2-methoxyethyl)-4-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]oxy-benzamide Formula: C20H28ClN4O3+ MolecularWeight: 407.91432

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C[NH+]2CCC(CC2)OC3=C(C=C(C=C3)C(=O)NCCOC)Cl

Isomeric SMILES

CN1C=C(C=N1)C[NH+]2CCC(CC2)OC3=C(C=C(C=C3)C(=O)NCCOC)Cl

InChI

InChI=1S/C20H27ClN4O3/c1-24-13-15(12-23-24)14-25-8-5-17(6-9-25)28-19-4-3-16(11-18(19)21)20(26)22-7-10-27-2/h3-4,11-13,17H,5-10,14H2,1-2H3,(H,22,26)/p+1