(3R)-1-(cyclobutylmethyl)-3-[[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]methyl]-3-oxidanyl-piperidin-2-one

Systemtic Name: (3R)-1-(cyclobutylmethyl)-3-[[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]methyl]-3-oxidanyl-piperidin-2-one Openeye Name: (3R)-1-(cyclobutylmethyl)-3-hydroxy-3-[[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]methyl]piperidin-2-one CAS Name: (3R)-1-(cyclobutylmethyl)-3-hydroxy-3-[[4-(6-methyl-2-pyridin-1-iumyl)-1-piperazinyl]methyl]-2-piperidinone IUPAC Name: (3R)-1-(cyclobutylmethyl)-3-hydroxy-3-[[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]methyl]piperidin-2-one Traditional Name: (3R)-1-(cyclobutylmethyl)-3-hydroxy-3-[[4-(6-methylpyridin-1-ium-2-yl)piperazino]methyl]-2-piperidone Formula: C21H33N4O2+ MolecularWeight: 373.51232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=CC=C1)N2CCN(CC2)CC3(CCCN(C3=O)CC4CCC4)O

Isomeric SMILES

CC1=[NH+]C(=CC=C1)N2CCN(CC2)C[C@@]3(CCCN(C3=O)CC4CCC4)O

InChI

InChI=1S/C21H32N4O2/c1-17-5-2-8-19(22-17)24-13-11-23(12-14-24)16-21(27)9-4-10-25(20(21)26)15-18-6-3-7-18/h2,5,8,18,27H,3-4,6-7,9-16H2,1H3/p+1/t21-/m1/s1