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

Systemtic Name: 2-[(4-acetyloxy-2-azanyl-phenyl)methyl]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 2-[(4-acetoxy-2-amino-phenyl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 2-[(4-acetyloxy-2-aminophenyl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 2-[(4-acetyloxy-2-aminophenyl)methyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 2-(4-acetoxy-2-amino-benzyl)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC(=C(C=C1)CC2(C(SC3N2C(=O)C3)(C)C)C(=O)O)N

Isomeric SMILES

CC(=O)OC1=CC(=C(C=C1)CC2(C(SC3N2C(=O)C3)(C)C)C(=O)O)N

InChI

InChI=1S/C17H20N2O5S/c1-9(20)24-11-5-4-10(12(18)6-11)8-17(15(22)23)16(2,3)25-14-7-13(21)19(14)17/h4-6,14H,7-8,18H2,1-3H3,(H,22,23)