3-bromanyl-5-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)benzaldehyde

Systemtic Name: 3-bromanyl-5-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)benzaldehyde Openeye Name: 3-bromo-5-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)benzaldehyde CAS Name: 3-bromo-5-ethoxy-4-[2-(1-piperidin-1-iumyl)ethoxy]benzaldehyde IUPAC Name: 3-bromo-5-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)benzaldehyde Traditional Name: 3-bromo-5-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)benzaldehyde Formula: C16H23BrNO3+ MolecularWeight: 357.26272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=O)Br)OCC[NH+]2CCCCC2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=O)Br)OCC[NH+]2CCCCC2

InChI

InChI=1S/C16H22BrNO3/c1-2-20-15-11-13(12-19)10-14(17)16(15)21-9-8-18-6-4-3-5-7-18/h10-12H,2-9H2,1H3/p+1