2-methoxy-4-(5-piperidin-1-ium-1-ylpenta-1,3-diynyl)phenol

Systemtic Name: 2-methoxy-4-(5-piperidin-1-ium-1-ylpenta-1,3-diynyl)phenol Openeye Name: 2-methoxy-4-(5-piperidin-1-ium-1-ylpenta-1,3-diynyl)phenol CAS Name: 2-methoxy-4-[5-(1-piperidin-1-iumyl)penta-1,3-diynyl]phenol IUPAC Name: 2-methoxy-4-(5-piperidin-1-ium-1-ylpenta-1,3-diynyl)phenol Traditional Name: 2-methoxy-4-(5-piperidin-1-ium-1-ylpenta-1,3-diynyl)phenol Formula: C17H20NO2+ MolecularWeight: 270.3462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#CC#CC[NH+]2CCCCC2)O

Isomeric SMILES

COC1=C(C=CC(=C1)C#CC#CC[NH+]2CCCCC2)O

InChI

InChI=1S/C17H19NO2/c1-20-17-14-15(9-10-16(17)19)8-4-2-5-11-18-12-6-3-7-13-18/h9-10,14,19H,3,6-7,11-13H2,1H3/p+1