(2S)-2-[[2,4-bis(oxidanylidene)thiochromen-3-yl]carbonylamino]propanoic acid

Systemtic Name: (2S)-2-[[2,4-bis(oxidanylidene)thiochromen-3-yl]carbonylamino]propanoic acid Openeye Name: (2S)-2-[(2,4-dioxothiochromane-3-carbonyl)amino]propanoic acid CAS Name: (2S)-2-[[(2,4-dioxo-1-benzothiopyran-3-yl)-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-2-[(2,4-dioxothiochromene-3-carbonyl)amino]propanoic acid Traditional Name: (2S)-2-[(2,4-diketothiochroman-3-carbonyl)amino]propionic acid Formula: C13H11NO5S MolecularWeight: 293.29514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1C(=O)C2=CC=CC=C2SC1=O

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)C1C(=O)C2=CC=CC=C2SC1=O

InChI

InChI=1S/C13H11NO5S/c1-6(12(17)18)14-11(16)9-10(15)7-4-2-3-5-8(7)20-13(9)19/h2-6,9H,1H3,(H,14,16)(H,17,18)/t6-,9?/m0/s1