[1-[(2S)-2-(4-ethanoylpiperazin-1-ium-1-yl)-3-methyl-butanoyl]piperidin-4-yl]azanium

Systemtic Name: [1-[(2S)-2-(4-ethanoylpiperazin-1-ium-1-yl)-3-methyl-butanoyl]piperidin-4-yl]azanium Openeye Name: [1-[(2S)-2-(4-acetylpiperazin-1-ium-1-yl)-3-methyl-butanoyl]-4-piperidyl]ammonium CAS Name: [1-[(2S)-2-(4-acetyl-1-piperazin-1-iumyl)-3-methyl-1-oxobutyl]-4-piperidinyl]ammonium IUPAC Name: [1-[(2S)-2-(4-acetylpiperazin-1-ium-1-yl)-3-methylbutanoyl]piperidin-4-yl]azanium Traditional Name: [1-[(2S)-2-(4-acetylpiperazin-1-ium-1-yl)-3-methyl-butanoyl]-4-piperidyl]ammonium Formula: C16H32N4O2+2 MolecularWeight: 312.45088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC(CC1)[NH3+])[NH+]2CCN(CC2)C(=O)C

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC(CC1)[NH3+])[NH+]2CCN(CC2)C(=O)C

InChI

InChI=1S/C16H30N4O2/c1-12(2)15(16(22)20-6-4-14(17)5-7-20)19-10-8-18(9-11-19)13(3)21/h12,14-15H,4-11,17H2,1-3H3/p+2/t15-/m0/s1