1-[(2-bromanyl-4,5-diethoxy-phenyl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2-bromanyl-4,5-diethoxy-phenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(2-bromo-4,5-diethoxy-phenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2-bromo-4,5-diethoxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2-bromo-4,5-diethoxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(2-bromo-4,5-diethoxy-benzyl)piperidin-1-ium-4-carboxamide Formula: C17H26BrN2O3+ MolecularWeight: 386.30394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C[NH+]2CCC(CC2)C(=O)N)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C[NH+]2CCC(CC2)C(=O)N)Br)OCC

InChI

InChI=1S/C17H25BrN2O3/c1-3-22-15-9-13(14(18)10-16(15)23-4-2)11-20-7-5-12(6-8-20)17(19)21/h9-10,12H,3-8,11H2,1-2H3,(H2,19,21)/p+1