2-[4-[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-ium-1-yl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[4-[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-ium-1-yl]-N,N-diethyl-ethanamide Openeye Name: 2-[4-[2-(butylcarbamoylamino)-2-oxo-ethyl]-1,4-diazepan-1-ium-1-yl]-N,N-diethyl-acetamide CAS Name: 2-[4-[2-[[butylamino(oxo)methyl]amino]-2-oxoethyl]-1,4-diazepan-1-ium-1-yl]-N,N-diethylacetamide IUPAC Name: 2-[4-[2-(butylcarbamoylamino)-2-oxoethyl]-1,4-diazepan-1-ium-1-yl]-N,N-diethylacetamide Traditional Name: 2-[4-[2-(butylcarbamoylamino)-2-keto-ethyl]-1,4-diazepan-1-ium-1-yl]-N,N-diethyl-acetamide Formula: C18H36N5O3+ MolecularWeight: 370.51014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)CN1CCC[NH+](CC1)CC(=O)N(CC)CC

Isomeric SMILES

CCCCNC(=O)NC(=O)CN1CCC[NH+](CC1)CC(=O)N(CC)CC

InChI

InChI=1S/C18H35N5O3/c1-4-7-9-19-18(26)20-16(24)14-21-10-8-11-22(13-12-21)15-17(25)23(5-2)6-3/h4-15H2,1-3H3,(H2,19,20,24,26)/p+1