[(2R)-3-[4-(2-ethylbutanoyl)piperazin-1-yl]-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2R)-3-[4-(2-ethylbutanoyl)piperazin-1-yl]-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2R)-3-[4-(2-ethylbutanoyl)piperazin-1-yl]-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2R)-3-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]-2-hydroxypropyl]-methylammonium IUPAC Name: [(2R)-3-[4-(2-ethylbutanoyl)piperazin-1-yl]-2-hydroxypropyl]-methylazanium Traditional Name: [(2R)-3-[4-(2-ethylbutanoyl)piperazino]-2-hydroxy-propyl]-methyl-ammonium Formula: C14H30N3O2+ MolecularWeight: 272.4069

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCN(CC1)CC(C[NH2+]C)O

Isomeric SMILES

CCC(CC)C(=O)N1CCN(CC1)C[C@@H](C[NH2+]C)O

InChI

InChI=1S/C14H29N3O2/c1-4-12(5-2)14(19)17-8-6-16(7-9-17)11-13(18)10-15-3/h12-13,15,18H,4-11H2,1-3H3/p+1/t13-/m1/s1