(2S)-2-[[1,1-bis(oxidanylidene)-1-benzothiophen-2-yl]methoxycarbonylamino]butanoic acid

Systemtic Name: (2S)-2-[[1,1-bis(oxidanylidene)-1-benzothiophen-2-yl]methoxycarbonylamino]butanoic acid Openeye Name: (2S)-2-[(1,1-dioxobenzothiophen-2-yl)methoxycarbonylamino]butanoic acid CAS Name: (2S)-2-[[(1,1-dioxo-1-benzothiophen-2-yl)methoxy-oxomethyl]amino]butanoic acid IUPAC Name: (2S)-2-[(1,1-dioxo-1-benzothiophen-2-yl)methoxycarbonylamino]butanoic acid Traditional Name: (2S)-2-[(1,1-diketobenzothiophen-2-yl)methoxycarbonylamino]butyric acid Formula: C14H15NO6S MolecularWeight: 325.337

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)OCC1=CC2=CC=CC=C2S1(=O)=O

Isomeric SMILES

CC[C@@H](C(=O)O)NC(=O)OCC1=CC2=CC=CC=C2S1(=O)=O

InChI

InChI=1S/C14H15NO6S/c1-2-11(13(16)17)15-14(18)21-8-10-7-9-5-3-4-6-12(9)22(10,19)20/h3-7,11H,2,8H2,1H3,(H,15,18)(H,16,17)/t11-/m0/s1