3-(morpholin-4-ium-4-ylmethyl)-4-oxidanyl-benzaldehyde

Systemtic Name: 3-(morpholin-4-ium-4-ylmethyl)-4-oxidanyl-benzaldehyde Openeye Name: 4-hydroxy-3-(morpholin-4-ium-4-ylmethyl)benzaldehyde CAS Name: 4-hydroxy-3-(4-morpholin-4-iumylmethyl)benzaldehyde IUPAC Name: 4-hydroxy-3-(morpholin-4-ium-4-ylmethyl)benzaldehyde Traditional Name: 4-hydroxy-3-(morpholin-4-ium-4-ylmethyl)benzaldehyde Formula: C12H16NO3+ MolecularWeight: 222.26034

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=C(C=CC(=C2)C=O)O

Isomeric SMILES

C1COCC[NH+]1CC2=C(C=CC(=C2)C=O)O

InChI

InChI=1S/C12H15NO3/c14-9-10-1-2-12(15)11(7-10)8-13-3-5-16-6-4-13/h1-2,7,9,15H,3-6,8H2/p+1