2-[[1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]methoxycarbonylamino]ethanoic acid

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]methoxycarbonylamino]ethanoic acid Openeye Name: 2-[(1,1-dioxobenzothiophen-3-yl)methoxycarbonylamino]acetic acid CAS Name: 2-[[(1,1-dioxo-1-benzothiophen-3-yl)methoxy-oxomethyl]amino]acetic acid IUPAC Name: 2-[(1,1-dioxo-1-benzothiophen-3-yl)methoxycarbonylamino]acetic acid Traditional Name: 2-[(1,1-diketobenzothiophen-3-yl)methoxycarbonylamino]acetic acid Formula: C12H11NO6S MolecularWeight: 297.28384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2(=O)=O)COC(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2(=O)=O)COC(=O)NCC(=O)O

InChI

InChI=1S/C12H11NO6S/c14-11(15)5-13-12(16)19-6-8-7-20(17,18)10-4-2-1-3-9(8)10/h1-4,7H,5-6H2,(H,13,16)(H,14,15)