3,3-dimethyl-7-oxidanylidene-6-(2-phenoxyethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2,6-dicarboxylic acid

Systemtic Name: 3,3-dimethyl-7-oxidanylidene-6-(2-phenoxyethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2,6-dicarboxylic acid Openeye Name: 3,3-dimethyl-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2,6-dicarboxylic acid CAS Name: 3,3-dimethyl-7-oxo-6-[(1-oxo-2-phenoxyethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2,6-dicarboxylic acid IUPAC Name: 3,3-dimethyl-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2,6-dicarboxylic acid Traditional Name: 7-keto-3,3-dimethyl-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2,6-dicarboxylic acid Formula: C17H18N2O7S MolecularWeight: 394.39902

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)(C(=O)O)NC(=O)COC3=CC=CC=C3)C(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)(C(=O)O)NC(=O)COC3=CC=CC=C3)C(=O)O)C

InChI

InChI=1S/C17H18N2O7S/c1-16(2)11(12(21)22)19-13(23)17(15(24)25,14(19)27-16)18-10(20)8-26-9-6-4-3-5-7-9/h3-7,11,14H,8H2,1-2H3,(H,18,20)(H,21,22)(H,24,25)