(2-phenyl-1,3-oxazol-4-yl)methyl-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]azanium

Systemtic Name: (2-phenyl-1,3-oxazol-4-yl)methyl-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]azanium Openeye Name: (2-phenyloxazol-4-yl)methyl-[(3S)-1-pyrimidin-2-yl-3-piperidyl]ammonium CAS Name: (2-phenyl-4-oxazolyl)methyl-[(3S)-1-(2-pyrimidinyl)-3-piperidinyl]ammonium IUPAC Name: (2-phenyl-1,3-oxazol-4-yl)methyl-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]azanium Traditional Name: (2-phenyloxazol-4-yl)methyl-[(3S)-1-(2-pyrimidyl)-3-piperidyl]ammonium Formula: C19H22N5O+ MolecularWeight: 336.41088

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)[NH2+]CC3=COC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=CC=N2)[NH2+]CC3=COC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H21N5O/c1-2-6-15(7-3-1)18-23-17(14-25-18)12-22-16-8-4-11-24(13-16)19-20-9-5-10-21-19/h1-3,5-7,9-10,14,16,22H,4,8,11-13H2/p+1/t16-/m0/s1