2-[(2S)-1-methyl-4-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-methyl-4-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-methyl-4-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-methyl-4-[(3-methyl-1-propyl-4-pyrazolyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-methyl-4-[(3-methyl-1-propylpyrazol-4-yl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-methyl-4-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperazin-1-ium-2-yl]ethanol Formula: C15H29N4O+ MolecularWeight: 281.41696

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)C)CN2CC[NH+](C(C2)CCO)C

Isomeric SMILES

CCCN1C=C(C(=N1)C)CN2CC[NH+]([C@H](C2)CCO)C

InChI

InChI=1S/C15H28N4O/c1-4-6-19-11-14(13(2)16-19)10-18-8-7-17(3)15(12-18)5-9-20/h11,15,20H,4-10,12H2,1-3H3/p+1/t15-/m0/s1