[(3R)-1-(cyclohexylmethyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-[(4,6-dimethylpyrimidin-2-yl)methyl]azanium

Systemtic Name: [(3R)-1-(cyclohexylmethyl)-3-oxidanyl-2-oxidanylidene-piperidin-3-yl]methyl-[(4,6-dimethylpyrimidin-2-yl)methyl]azanium Openeye Name: [(3R)-1-(cyclohexylmethyl)-3-hydroxy-2-oxo-3-piperidyl]methyl-[(4,6-dimethylpyrimidin-2-yl)methyl]ammonium CAS Name: [(3R)-1-(cyclohexylmethyl)-3-hydroxy-2-oxo-3-piperidinyl]methyl-[(4,6-dimethyl-2-pyrimidinyl)methyl]ammonium IUPAC Name: [(3R)-1-(cyclohexylmethyl)-3-hydroxy-2-oxopiperidin-3-yl]methyl-[(4,6-dimethylpyrimidin-2-yl)methyl]azanium Traditional Name: [(3R)-1-(cyclohexylmethyl)-3-hydroxy-2-keto-3-piperidyl]methyl-[(4,6-dimethylpyrimidin-2-yl)methyl]ammonium Formula: C20H33N4O2+ MolecularWeight: 361.50162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C[NH2+]CC2(CCCN(C2=O)CC3CCCCC3)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)C[NH2+]C[C@@]2(CCCN(C2=O)CC3CCCCC3)O)C

InChI

InChI=1S/C20H32N4O2/c1-15-11-16(2)23-18(22-15)12-21-14-20(26)9-6-10-24(19(20)25)13-17-7-4-3-5-8-17/h11,17,21,26H,3-10,12-14H2,1-2H3/p+1/t20-/m1/s1