[2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-oxidanylidene-ethyl]-(2-methylbutan-2-yl)azanium

Systemtic Name: [2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-oxidanylidene-ethyl]-(2-methylbutan-2-yl)azanium Openeye Name: [2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-oxo-ethyl]-(1,1-dimethylpropyl)ammonium CAS Name: [2-[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]-2-oxoethyl]-(2-methylbutan-2-yl)ammonium IUPAC Name: [2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-oxoethyl]-(2-methylbutan-2-yl)azanium Traditional Name: tert-amyl-[2-(1,3-benzodioxol-5-ylcarbamoylamino)-2-keto-ethyl]ammonium Formula: C15H22N3O4+ MolecularWeight: 308.35288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)[NH2+]CC(=O)NC(=O)NC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCC(C)(C)[NH2+]CC(=O)NC(=O)NC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C15H21N3O4/c1-4-15(2,3)16-8-13(19)18-14(20)17-10-5-6-11-12(7-10)22-9-21-11/h5-7,16H,4,8-9H2,1-3H3,(H2,17,18,19,20)/p+1