[(4S)-4-[[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]azaniumyl]pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-[[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]azaniumyl]pentyl]-diethyl-azanium Openeye Name: [(4S)-4-[[(1R)-2-amino-1-methyl-2-oxo-ethyl]ammonio]pentyl]-diethyl-ammonium CAS Name: [(4S)-4-[[(2R)-1-amino-1-oxopropan-2-yl]ammonio]pentyl]-diethylammonium IUPAC Name: [(4S)-4-[[(2R)-1-amino-1-oxopropan-2-yl]azaniumyl]pentyl]-diethylazanium Traditional Name: [(4S)-4-[[(1R)-2-amino-2-keto-1-methyl-ethyl]ammonio]pentyl]-diethyl-ammonium Formula: C12H29N3O+2 MolecularWeight: 231.37816

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)[NH2+]C(C)C(=O)N

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)C(=O)N

InChI

InChI=1S/C12H27N3O/c1-5-15(6-2)9-7-8-10(3)14-11(4)12(13)16/h10-11,14H,5-9H2,1-4H3,(H2,13,16)/p+2/t10-,11+/m0/s1