3-[2-[(2R)-2-aminocarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: 3-[2-[(2R)-2-aminocarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: 3-[2-[(2R)-2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-[(2R)-2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-oxoethyl]thio]propanoate IUPAC Name: 3-[2-[(2R)-2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-[(2R)-2-carbamoyl-2,3-dihydro-1,4-benzoxazin-4-yl]-2-keto-ethyl]thio]propionate Formula: C14H15N2O5S- MolecularWeight: 323.3443

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1C(=O)CSCCC(=O)[O-])C(=O)N

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2N1C(=O)CSCCC(=O)[O-])C(=O)N

InChI

InChI=1S/C14H16N2O5S/c15-14(20)11-7-16(9-3-1-2-4-10(9)21-11)12(17)8-22-6-5-13(18)19/h1-4,11H,5-8H2,(H2,15,20)(H,18,19)/p-1/t11-/m1/s1