3-[(4-acetamidophenoxy)methyl]-7-azanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-[(4-acetamidophenoxy)methyl]-7-azanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-[(4-acetamidophenoxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-[(4-acetamidophenoxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-[(4-acetamidophenoxy)methyl]-7-amino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-[(4-acetamidophenoxy)methyl]-7-amino-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OCC2=C(N3C(C(C3=O)N)SC2)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OCC2=C(N3C(C(C3=O)N)SC2)C(=O)O

InChI

InChI=1S/C16H17N3O5S/c1-8(20)18-10-2-4-11(5-3-10)24-6-9-7-25-15-12(17)14(21)19(15)13(9)16(22)23/h2-5,12,15H,6-7,17H2,1H3,(H,18,20)(H,22,23)