4-[2-(1-methylpiperidin-1-ium-1-yl)ethylamino]benzaldehyde

Systemtic Name: 4-[2-(1-methylpiperidin-1-ium-1-yl)ethylamino]benzaldehyde Openeye Name: 4-[2-(1-methylpiperidin-1-ium-1-yl)ethylamino]benzaldehyde CAS Name: 4-[2-(1-methyl-1-piperidin-1-iumyl)ethylamino]benzaldehyde IUPAC Name: 4-[2-(1-methylpiperidin-1-ium-1-yl)ethylamino]benzaldehyde Traditional Name: 4-[2-(1-methylpiperidin-1-ium-1-yl)ethylamino]benzaldehyde Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCNC2=CC=C(C=C2)C=O

Isomeric SMILES

C[N+]1(CCCCC1)CCNC2=CC=C(C=C2)C=O

InChI

InChI=1S/C15H22N2O/c1-17(10-3-2-4-11-17)12-9-16-15-7-5-14(13-18)6-8-15/h5-8,13H,2-4,9-12H2,1H3/p+1