2-oxidanylidene-3-(phenylmethyl)-5-thiophen-3-yl-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid

Systemtic Name: 2-oxidanylidene-3-(phenylmethyl)-5-thiophen-3-yl-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid Openeye Name: 3-benzyl-2-oxo-5-(3-thienyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid CAS Name: 2-oxo-3-(phenylmethyl)-5-(3-thiophenyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid IUPAC Name: 3-benzyl-2-oxo-5-thiophen-3-yl-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid Traditional Name: 3-benzyl-2-keto-5-(3-thienyl)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid Formula: C17H15NO5S MolecularWeight: 345.3697

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Descriptors Computed from Structure

Canonical SMILES:

C1C2(OC(C(O2)C(=O)O)C(=O)N1CC3=CC=CC=C3)C4=CSC=C4

Isomeric SMILES

C1C2(OC(C(O2)C(=O)O)C(=O)N1CC3=CC=CC=C3)C4=CSC=C4

InChI

InChI=1S/C17H15NO5S/c19-15-13-14(16(20)21)23-17(22-13,12-6-7-24-9-12)10-18(15)8-11-4-2-1-3-5-11/h1-7,9,13-14H,8,10H2,(H,20,21)