3-piperidin-1-ium-1-yl-1-(4-propan-2-yloxyphenyl)propan-1-one

Systemtic Name: 3-piperidin-1-ium-1-yl-1-(4-propan-2-yloxyphenyl)propan-1-one Openeye Name: 1-(4-isopropoxyphenyl)-3-piperidin-1-ium-1-yl-propan-1-one CAS Name: 3-(1-piperidin-1-iumyl)-1-(4-propan-2-yloxyphenyl)-1-propanone IUPAC Name: 3-piperidin-1-ium-1-yl-1-(4-propan-2-yloxyphenyl)propan-1-one Traditional Name: 1-(4-isopropoxyphenyl)-3-piperidin-1-ium-1-yl-propan-1-one Formula: C17H26NO2+ MolecularWeight: 276.39384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)CC[NH+]2CCCCC2

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)CC[NH+]2CCCCC2

InChI

InChI=1S/C17H25NO2/c1-14(2)20-16-8-6-15(7-9-16)17(19)10-13-18-11-4-3-5-12-18/h6-9,14H,3-5,10-13H2,1-2H3/p+1