(1S,2S)-2-[4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methyl]piperazin-4-ium-1-yl]cyclohexan-1-ol

Systemtic Name: (1S,2S)-2-[4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methyl]piperazin-4-ium-1-yl]cyclohexan-1-ol Openeye Name: (1S,2S)-2-[4-[(2-ethyl-4-methyl-oxazol-5-yl)methyl]piperazin-4-ium-1-yl]cyclohexanol CAS Name: (1S,2S)-2-[4-[(2-ethyl-4-methyl-5-oxazolyl)methyl]-1-piperazin-4-iumyl]-1-cyclohexanol IUPAC Name: (1S,2S)-2-[4-[(2-ethyl-4-methyl-1,3-oxazol-5-yl)methyl]piperazin-4-ium-1-yl]cyclohexan-1-ol Traditional Name: (1S,2S)-2-[4-[(2-ethyl-4-methyl-oxazol-5-yl)methyl]piperazin-4-ium-1-yl]cyclohexanol Formula: C17H30N3O2+ MolecularWeight: 308.439

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(O1)C[NH+]2CCN(CC2)C3CCCCC3O)C

Isomeric SMILES

CCC1=NC(=C(O1)C[NH+]2CCN(CC2)[C@H]3CCCC[C@@H]3O)C

InChI

InChI=1S/C17H29N3O2/c1-3-17-18-13(2)16(22-17)12-19-8-10-20(11-9-19)14-6-4-5-7-15(14)21/h14-15,21H,3-12H2,1-2H3/p+1/t14-,15-/m0/s1