[1-[(1,3-benzodioxol-5-ylcarbamoylamino)methyl]cycloheptyl]-dimethyl-azanium

Systemtic Name: [1-[(1,3-benzodioxol-5-ylcarbamoylamino)methyl]cycloheptyl]-dimethyl-azanium Openeye Name: [1-[(1,3-benzodioxol-5-ylcarbamoylamino)methyl]cycloheptyl]-dimethyl-ammonium CAS Name: [1-[[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]methyl]cycloheptyl]-dimethylammonium IUPAC Name: [1-[(1,3-benzodioxol-5-ylcarbamoylamino)methyl]cycloheptyl]-dimethylazanium Traditional Name: [1-[(1,3-benzodioxol-5-ylcarbamoylamino)methyl]cycloheptyl]-dimethyl-ammonium Formula: C18H28N3O3+ MolecularWeight: 334.43322

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1(CCCCCC1)CNC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[NH+](C)C1(CCCCCC1)CNC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H27N3O3/c1-21(2)18(9-5-3-4-6-10-18)12-19-17(22)20-14-7-8-15-16(11-14)24-13-23-15/h7-8,11H,3-6,9-10,12-13H2,1-2H3,(H2,19,20,22)/p+1