(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(thiophen-2-ylcarbonylamino)ethanoate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(thiophen-2-ylcarbonylamino)ethanoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(thiophene-2-carbonylamino)acetate CAS Name: 2-[[oxo(thiophen-2-yl)methyl]amino]acetic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(thiophene-2-carbonylamino)acetate Traditional Name: 2-(2-thenoylamino)acetic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C16H14N2O7S MolecularWeight: 378.35656

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)CNC(=O)C3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)CNC(=O)C3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O7S/c19-14(6-17-16(20)13-2-1-3-26-13)24-8-11-5-12(18(21)22)4-10-7-23-9-25-15(10)11/h1-5H,6-9H2,(H,17,20)