3-[[(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]azaniumyl]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[[(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl]azaniumyl]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[3-[[(1S)-1-methyl-2-oxo-2-ureido-ethyl]ammonio]propyl]ammonium CAS Name: 3-[[(2S)-1-(carbamoylamino)-1-oxopropan-2-yl]ammonio]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[(2S)-1-(carbamoylamino)-1-oxopropan-2-yl]azaniumyl]propyl]-methylazanium Traditional Name: benzyl-[3-[[(1S)-2-keto-1-methyl-2-ureido-ethyl]ammonio]propyl]-methyl-ammonium Formula: C15H26N4O2+2 MolecularWeight: 294.39254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NC(=O)N)[NH2+]CCC[NH+](C)CC1=CC=CC=C1

InChI

InChI=1S/C15H24N4O2/c1-12(14(20)18-15(16)21)17-9-6-10-19(2)11-13-7-4-3-5-8-13/h3-5,7-8,12,17H,6,9-11H2,1-2H3,(H3,16,18,20,21)/p+2/t12-/m0/s1