4-oxidanyl-3-(piperidin-1-ium-1-ylmethyl)benzaldehyde

Systemtic Name: 4-oxidanyl-3-(piperidin-1-ium-1-ylmethyl)benzaldehyde Openeye Name: 4-hydroxy-3-(piperidin-1-ium-1-ylmethyl)benzaldehyde CAS Name: 4-hydroxy-3-(1-piperidin-1-iumylmethyl)benzaldehyde IUPAC Name: 4-hydroxy-3-(piperidin-1-ium-1-ylmethyl)benzaldehyde Traditional Name: 4-hydroxy-3-(piperidin-1-ium-1-ylmethyl)benzaldehyde Formula: C13H18NO2+ MolecularWeight: 220.28752

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=C(C=CC(=C2)C=O)O

Isomeric SMILES

C1CC[NH+](CC1)CC2=C(C=CC(=C2)C=O)O

InChI

InChI=1S/C13H17NO2/c15-10-11-4-5-13(16)12(8-11)9-14-6-2-1-3-7-14/h4-5,8,10,16H,1-3,6-7,9H2/p+1