2-[(3,3-dimethyl-7-oxidanylidene-2-phosphono-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-2-oxidanylidene-1-phenyl-ethanesulfonic acid

Systemtic Name: 2-[(3,3-dimethyl-7-oxidanylidene-2-phosphono-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-2-oxidanylidene-1-phenyl-ethanesulfonic acid Openeye Name: 2-[(3,3-dimethyl-7-oxo-2-phosphono-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-2-oxo-1-phenyl-ethanesulfonic acid CAS Name: 2-[(3,3-dimethyl-7-oxo-2-phosphono-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-2-oxo-1-phenylethanesulfonic acid IUPAC Name: 2-[(3,3-dimethyl-7-oxo-2-phosphono-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-2-oxo-1-phenylethanesulfonic acid Traditional Name: 2-keto-2-[(7-keto-3,3-dimethyl-2-phosphono-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)amino]-1-phenyl-ethanesulfonic acid Formula: C15H19N2O8PS2 MolecularWeight: 450.423721

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)S(=O)(=O)O)P(=O)(O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)S(=O)(=O)O)P(=O)(O)O)C

InChI

InChI=1S/C15H19N2O8PS2/c1-15(2)14(26(20,21)22)17-12(19)9(13(17)27-15)16-11(18)10(28(23,24)25)8-6-4-3-5-7-8/h3-7,9-10,13-14H,1-2H3,(H,16,18)(H2,20,21,22)(H,23,24,25)