2-(2-bromanyl-4,5-diethoxy-phenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: 2-(2-bromanyl-4,5-diethoxy-phenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-(2-bromo-4,5-diethoxy-phenyl)-N-(1-isopropylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-(2-bromo-4,5-diethoxyphenyl)-N-(1-propan-2-yl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-(2-bromo-4,5-diethoxyphenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-(2-bromo-4,5-diethoxy-phenyl)-N-(1-isopropylpiperidin-1-ium-4-yl)acetamide Formula: C20H32BrN2O3+ MolecularWeight: 428.38368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CC(=O)NC2CC[NH+](CC2)C(C)C)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CC(=O)NC2CC[NH+](CC2)C(C)C)Br)OCC

InChI

InChI=1S/C20H31BrN2O3/c1-5-25-18-11-15(17(21)13-19(18)26-6-2)12-20(24)22-16-7-9-23(10-8-16)14(3)4/h11,13-14,16H,5-10,12H2,1-4H3,(H,22,24)/p+1