diethyl-[3-[(5-oxidanylidene-1,2-dihydropyrazol-3-yl)carbonyl-(propan-2-ylamino)amino]propyl]azanium

Systemtic Name: diethyl-[3-[(5-oxidanylidene-1,2-dihydropyrazol-3-yl)carbonyl-(propan-2-ylamino)amino]propyl]azanium Openeye Name: diethyl-[3-[(isopropylamino)-(5-oxo-1,2-dihydropyrazole-3-carbonyl)amino]propyl]ammonium CAS Name: diethyl-[3-[[oxo-(5-oxo-1,2-dihydropyrazol-3-yl)methyl]-(propan-2-ylamino)amino]propyl]ammonium IUPAC Name: diethyl-[3-[(5-oxo-1,2-dihydropyrazole-3-carbonyl)-(propan-2-ylamino)amino]propyl]azanium Traditional Name: diethyl-[3-[(isopropylamino)-(5-keto-3-pyrazoline-3-carbonyl)amino]propyl]ammonium Formula: C14H28N5O2+ MolecularWeight: 298.40442

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN(C(=O)C1=CC(=O)NN1)NC(C)C

Isomeric SMILES

CC[NH+](CC)CCCN(C(=O)C1=CC(=O)NN1)NC(C)C

InChI

InChI=1S/C14H27N5O2/c1-5-18(6-2)8-7-9-19(17-11(3)4)14(21)12-10-13(20)16-15-12/h10-11,17H,5-9H2,1-4H3,(H2,15,16,20)/p+1