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1,3-benzodioxol-5-ylmethyl-[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium

1,3-benzodioxol-5-ylmethyl-[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name:1,3-benzodioxol-5-ylmethyl-[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium
Openeye Name:1,3-benzodioxol-5-ylmethyl-[2-(cyclohexylcarbamoylamino)-2-oxo-ethyl]-methyl-ammonium
CAS Name:1,3-benzodioxol-5-ylmethyl-[2-[[(cyclohexylamino)-oxomethyl]amino]-2-oxoethyl]-methylammonium
IUPAC Name:1,3-benzodioxol-5-ylmethyl-[2-(cyclohexylcarbamoylamino)-2-oxoethyl]-methylazanium
Traditional Name:[2-(cyclohexylcarbamoylamino)-2-keto-ethyl]-methyl-piperonyl-ammonium
Formula: C18H26N3O4+
MolecularWeight: 348.41674
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC(=O)NC3CCCCC3


Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)OCO2)CC(=O)NC(=O)NC3CCCCC3


InChI

InChI=1S/C18H25N3O4/c1-21(10-13-7-8-15-16(9-13)25-12-24-15)11-17(22)20-18(23)19-14-5-3-2-4-6-14/h7-9,14H,2-6,10-12H2,1H3,(H2,19,20,22,23)/p+1


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