(2S)-2-[2-(1,2-benzoxazol-3-yl)ethanoylamino]-3-oxidanyl-propanoic acid

Systemtic Name: (2S)-2-[2-(1,2-benzoxazol-3-yl)ethanoylamino]-3-oxidanyl-propanoic acid Openeye Name: (2S)-2-[[2-(1,2-benzoxazol-3-yl)acetyl]amino]-3-hydroxy-propanoic acid CAS Name: (2S)-2-[[2-(1,2-benzoxazol-3-yl)-1-oxoethyl]amino]-3-hydroxypropanoic acid IUPAC Name: (2S)-2-[[2-(1,2-benzoxazol-3-yl)acetyl]amino]-3-hydroxypropanoic acid Traditional Name: (2S)-3-hydroxy-2-[(2-indoxazen-3-ylacetyl)amino]propionic acid Formula: C12H12N2O5 MolecularWeight: 264.23408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NO2)CC(=O)NC(CO)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NO2)CC(=O)N[C@@H](CO)C(=O)O

InChI

InChI=1S/C12H12N2O5/c15-6-9(12(17)18)13-11(16)5-8-7-3-1-2-4-10(7)19-14-8/h1-4,9,15H,5-6H2,(H,13,16)(H,17,18)/t9-/m0/s1