[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: [2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: [2-(tert-butylcarbamoylamino)-2-oxo-ethyl] 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid [2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(tert-butylcarbamoylamino)-2-oxoethyl] 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid [2-(tert-butylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H21N3O7 MolecularWeight: 379.36454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)COC(=O)CNC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)COC(=O)CNC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C17H21N3O7/c1-17(2,3)20-16(24)19-13(21)8-25-14(22)7-18-15(23)10-4-5-11-12(6-10)27-9-26-11/h4-6H,7-9H2,1-3H3,(H,18,23)(H2,19,20,21,24)