methyl-[3-[[2-(2-methylpropylamino)-2-oxidanylidene-ethyl]azaniumyl]propyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[3-[[2-(2-methylpropylamino)-2-oxidanylidene-ethyl]azaniumyl]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[2-(isobutylamino)-2-oxo-ethyl]ammonio]propyl]-methyl-ammonium CAS Name: methyl-[3-[[2-(2-methylpropylamino)-2-oxoethyl]ammonio]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-[[2-(2-methylpropylamino)-2-oxoethyl]azaniumyl]propyl]azanium Traditional Name: benzyl-[3-[[2-(isobutylamino)-2-keto-ethyl]ammonio]propyl]-methyl-ammonium Formula: C17H31N3O+2 MolecularWeight: 293.44754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C[NH2+]CCC[NH+](C)CC1=CC=CC=C1

Isomeric SMILES

CC(C)CNC(=O)C[NH2+]CCC[NH+](C)CC1=CC=CC=C1

InChI

InChI=1S/C17H29N3O/c1-15(2)12-19-17(21)13-18-10-7-11-20(3)14-16-8-5-4-6-9-16/h4-6,8-9,15,18H,7,10-14H2,1-3H3,(H,19,21)/p+2