6-acetyloxy-3,3-dimethyl-7-oxidanylidene-6-(2-phenylethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-acetyloxy-3,3-dimethyl-7-oxidanylidene-6-(2-phenylethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-acetoxy-3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-acetyloxy-3,3-dimethyl-7-oxo-6-[(1-oxo-2-phenylethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-acetyloxy-3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-acetoxy-7-keto-3,3-dimethyl-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C2N(C1=O)C(C(S2)(C)C)C(=O)O)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1(C2N(C1=O)C(C(S2)(C)C)C(=O)O)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O6S/c1-10(21)26-18(19-12(22)9-11-7-5-4-6-8-11)15(25)20-13(14(23)24)17(2,3)27-16(18)20/h4-8,13,16H,9H2,1-3H3,(H,19,22)(H,23,24)