2-[(2-azido-2-phenyl-ethanoyl)amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: 2-[(2-azido-2-phenyl-ethanoyl)amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: 2-[(2-azido-2-phenyl-acetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 2-[(2-azido-1-oxo-2-phenylethyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate IUPAC Name: 2-[(2-azido-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 2-[(2-azido-2-phenyl-acetyl)amino]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Formula: C16H16N5O4S- MolecularWeight: 374.39434

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)CC2=O)(C(=O)[O-])NC(=O)C(C3=CC=CC=C3)N=[N+]=[N-])C

Isomeric SMILES

CC1(C(N2C(S1)CC2=O)(C(=O)[O-])NC(=O)C(C3=CC=CC=C3)N=[N+]=[N-])C

InChI

InChI=1S/C16H17N5O4S/c1-15(2)16(14(24)25,21-10(22)8-11(21)26-15)18-13(23)12(19-20-17)9-6-4-3-5-7-9/h3-7,11-12H,8H2,1-2H3,(H,18,23)(H,24,25)/p-1