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

Systemtic Name: 3-piperidin-1-ium-1-yl-1-(4-propan-2-ylphenyl)propan-1-one Openeye Name: 1-(4-isopropylphenyl)-3-piperidin-1-ium-1-yl-propan-1-one CAS Name: 3-(1-piperidin-1-iumyl)-1-(4-propan-2-ylphenyl)-1-propanone IUPAC Name: 3-piperidin-1-ium-1-yl-1-(4-propan-2-ylphenyl)propan-1-one Traditional Name: 1-p-cumenyl-3-piperidin-1-ium-1-yl-propan-1-one Formula: C17H26NO+ MolecularWeight: 260.39444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO/c1-14(2)15-6-8-16(9-7-15)17(19)10-13-18-11-4-3-5-12-18/h6-9,14H,3-5,10-13H2,1-2H3/p+1