[1-oxidanylidene-1-(phenylcarbamoylamino)propan-2-yl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate

Systemtic Name: [1-oxidanylidene-1-(phenylcarbamoylamino)propan-2-yl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Openeye Name: [1-methyl-2-oxo-2-(phenylcarbamoylamino)ethyl] 4-(tert-butoxycarbonylamino)benzoate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid [1-[[anilino(oxo)methyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-oxo-1-(phenylcarbamoylamino)propan-2-yl] 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Traditional Name: 4-(tert-butoxycarbonylamino)benzoic acid [2-keto-1-methyl-2-(phenylcarbamoylamino)ethyl] ester Formula: C22H25N3O6 MolecularWeight: 427.4504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C(=O)NC(=O)NC1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H25N3O6/c1-14(18(26)25-20(28)23-16-8-6-5-7-9-16)30-19(27)15-10-12-17(13-11-15)24-21(29)31-22(2,3)4/h5-14H,1-4H3,(H,24,29)(H2,23,25,26,28)