2-(2-aminophenyl)-N-(2-dimethoxyphosphoryl-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)ethanamide

Systemtic Name: 2-(2-aminophenyl)-N-(2-dimethoxyphosphoryl-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)ethanamide Openeye Name: 2-(2-aminophenyl)-N-(2-dimethoxyphosphoryl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)acetamide CAS Name: 2-(2-aminophenyl)-N-(2-dimethoxyphosphoryl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)acetamide IUPAC Name: 2-(2-aminophenyl)-N-(2-dimethoxyphosphoryl-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)acetamide Traditional Name: 2-(2-aminophenyl)-N-(2-dimethoxyphosphoryl-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl)acetamide Formula: C17H22N3O5PS MolecularWeight: 411.412441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CC=C3N)SC1)P(=O)(OC)OC

Isomeric SMILES

CC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CC=C3N)SC1)P(=O)(OC)OC

InChI

InChI=1S/C17H22N3O5PS/c1-10-9-27-17-14(15(22)20(17)16(10)26(23,24-2)25-3)19-13(21)8-11-6-4-5-7-12(11)18/h4-7,14,17H,8-9,18H2,1-3H3,(H,19,21)