[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-cyclooctyl-azanium

Systemtic Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-cyclooctyl-azanium Openeye Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]-cyclooctyl-ammonium CAS Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-cyclooctylammonium IUPAC Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-cyclooctylazanium Traditional Name: cyclooctyl-[2-keto-2-(piperonylamino)ethyl]ammonium Formula: C18H27N2O3+ MolecularWeight: 319.41858

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)[NH2+]CC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCCC(CCC1)[NH2+]CC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H26N2O3/c21-18(12-19-15-6-4-2-1-3-5-7-15)20-11-14-8-9-16-17(10-14)23-13-22-16/h8-10,15,19H,1-7,11-13H2,(H,20,21)/p+1