3-ethoxy-4-[2-[(2R)-2-methylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde

Systemtic Name: 3-ethoxy-4-[2-[(2R)-2-methylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde Openeye Name: 3-ethoxy-4-[2-[(2R)-2-methylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde CAS Name: 3-ethoxy-4-[2-[(2R)-2-methyl-1-piperidin-1-iumyl]ethoxy]benzaldehyde IUPAC Name: 3-ethoxy-4-[2-[(2R)-2-methylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde Traditional Name: 3-ethoxy-4-[2-[(2R)-2-methylpiperidin-1-ium-1-yl]ethoxy]benzaldehyde Formula: C17H26NO3+ MolecularWeight: 292.39324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=O)OCC[NH+]2CCCCC2C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=O)OCC[NH+]2CCCC[C@H]2C

InChI

InChI=1S/C17H25NO3/c1-3-20-17-12-15(13-19)7-8-16(17)21-11-10-18-9-5-4-6-14(18)2/h7-8,12-14H,3-6,9-11H2,1-2H3/p+1/t14-/m1/s1