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

Systemtic Name: [1-[(2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-3-methyl-butanoyl]piperidin-4-yl]azanium Openeye Name: [1-[(2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-3-methyl-butanoyl]-4-piperidyl]ammonium CAS Name: [1-[(2S)-2-[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]-3-methyl-1-oxobutyl]-4-piperidinyl]ammonium IUPAC Name: [1-[(2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-3-methylbutanoyl]piperidin-4-yl]azanium Traditional Name: [1-[(2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-3-methyl-butanoyl]-4-piperidyl]ammonium Formula: C16H34N4O2+2 MolecularWeight: 314.46676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H32N4O2/c1-13(2)15(16(22)20-5-3-14(17)4-6-20)19-9-7-18(8-10-19)11-12-21/h13-15,21H,3-12,17H2,1-2H3/p+2/t15-/m0/s1