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

Systemtic Name: [(4R)-4-[[(2S)-1-(butylamino)-1-oxidanylidene-propan-2-yl]azaniumyl]pentyl]-diethyl-azanium Openeye Name: [(4R)-4-[[(1S)-2-(butylamino)-1-methyl-2-oxo-ethyl]ammonio]pentyl]-diethyl-ammonium CAS Name: [(4R)-4-[[(2S)-1-(butylamino)-1-oxopropan-2-yl]ammonio]pentyl]-diethylammonium IUPAC Name: [(4R)-4-[[(2S)-1-(butylamino)-1-oxopropan-2-yl]azaniumyl]pentyl]-diethylazanium Traditional Name: [(4R)-4-[[(1S)-2-(butylamino)-2-keto-1-methyl-ethyl]ammonio]pentyl]-diethyl-ammonium Formula: C16H37N3O+2 MolecularWeight: 287.48448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)[NH2+]C(C)CCC[NH+](CC)CC

Isomeric SMILES

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

InChI

InChI=1S/C16H35N3O/c1-6-9-12-17-16(20)15(5)18-14(4)11-10-13-19(7-2)8-3/h14-15,18H,6-13H2,1-5H3,(H,17,20)/p+2/t14-,15+/m1/s1