(2S)-6-(2-oxidanidyl-2-oxidanylidene-ethyl)-4-thiophen-2-ylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate

Systemtic Name: (2S)-6-(2-oxidanidyl-2-oxidanylidene-ethyl)-4-thiophen-2-ylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate Openeye Name: (2S)-6-(2-oxido-2-oxo-ethyl)-4-(2-thienylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate CAS Name: (2S)-6-(2-oxido-2-oxoethyl)-4-thiophen-2-ylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate IUPAC Name: (2S)-6-(2-oxido-2-oxoethyl)-4-thiophen-2-ylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxylate Traditional Name: (2S)-6-(2-keto-2-oxido-ethyl)-4-(2-thienylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylate Formula: C15H11NO7S2-2 MolecularWeight: 381.38034

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(N1S(=O)(=O)C3=CC=CS3)C=C(C=C2)CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1[C@H](OC2=C(N1S(=O)(=O)C3=CC=CS3)C=C(C=C2)CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C15H13NO7S2/c17-13(18)7-9-3-4-11-10(6-9)16(8-12(23-11)15(19)20)25(21,22)14-2-1-5-24-14/h1-6,12H,7-8H2,(H,17,18)(H,19,20)/p-2/t12-/m0/s1