4-butoxy-3-chloranyl-5-ethoxy-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 4-butoxy-3-chloranyl-5-ethoxy-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide Openeye Name: 4-butoxy-3-chloro-5-ethoxy-N-(1-isopropylpiperidin-1-ium-4-yl)benzamide CAS Name: 4-butoxy-3-chloro-5-ethoxy-N-(1-propan-2-yl-4-piperidin-1-iumyl)benzamide IUPAC Name: 4-butoxy-3-chloro-5-ethoxy-N-(1-propan-2-ylpiperidin-1-ium-4-yl)benzamide Traditional Name: 4-butoxy-3-chloro-5-ethoxy-N-(1-isopropylpiperidin-1-ium-4-yl)benzamide Formula: C21H34ClN2O3+ MolecularWeight: 397.95926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)NC2CC[NH+](CC2)C(C)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)NC2CC[NH+](CC2)C(C)C)OCC

InChI

InChI=1S/C21H33ClN2O3/c1-5-7-12-27-20-18(22)13-16(14-19(20)26-6-2)21(25)23-17-8-10-24(11-9-17)15(3)4/h13-15,17H,5-12H2,1-4H3,(H,23,25)/p+1