1-morpholin-4-yl-3-[1-[(2,4,5-trimethylphenyl)methyl]piperidin-1-ium-4-yl]propan-1-one

Systemtic Name: 1-morpholin-4-yl-3-[1-[(2,4,5-trimethylphenyl)methyl]piperidin-1-ium-4-yl]propan-1-one Openeye Name: 1-morpholino-3-[1-[(2,4,5-trimethylphenyl)methyl]piperidin-1-ium-4-yl]propan-1-one CAS Name: 1-(4-morpholinyl)-3-[1-[(2,4,5-trimethylphenyl)methyl]-4-piperidin-1-iumyl]-1-propanone IUPAC Name: 1-morpholin-4-yl-3-[1-[(2,4,5-trimethylphenyl)methyl]piperidin-1-ium-4-yl]propan-1-one Traditional Name: 1-morpholino-3-[1-(2,4,5-trimethylbenzyl)piperidin-1-ium-4-yl]propan-1-one Formula: C22H35N2O2+ MolecularWeight: 359.5255

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)C[NH+]2CCC(CC2)CCC(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1C)C[NH+]2CCC(CC2)CCC(=O)N3CCOCC3)C

InChI

InChI=1S/C22H34N2O2/c1-17-14-19(3)21(15-18(17)2)16-23-8-6-20(7-9-23)4-5-22(25)24-10-12-26-13-11-24/h14-15,20H,4-13,16H2,1-3H3/p+1