[(2S)-4-(4-ethylpiperazin-4-ium-1-yl)butan-2-yl]azanium

Systemtic Name: [(2S)-4-(4-ethylpiperazin-4-ium-1-yl)butan-2-yl]azanium Openeye Name: [(1S)-3-(4-ethylpiperazin-4-ium-1-yl)-1-methyl-propyl]ammonium CAS Name: [(2S)-4-(4-ethyl-1-piperazin-4-iumyl)butan-2-yl]ammonium IUPAC Name: [(2S)-4-(4-ethylpiperazin-4-ium-1-yl)butan-2-yl]azanium Traditional Name: [(1S)-3-(4-ethylpiperazin-4-ium-1-yl)-1-methyl-propyl]ammonium Formula: C10H25N3+2 MolecularWeight: 187.3256

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CCC(C)[NH3+]

Isomeric SMILES

CC[NH+]1CCN(CC1)CC[C@H](C)[NH3+]

InChI

InChI=1S/C10H23N3/c1-3-12-6-8-13(9-7-12)5-4-10(2)11/h10H,3-9,11H2,1-2H3/p+2/t10-/m0/s1