(2S)-3-(1,3-benzoxazol-2-ylsulfanyl)-2-chloranyl-propanoate

Systemtic Name: (2S)-3-(1,3-benzoxazol-2-ylsulfanyl)-2-chloranyl-propanoate Openeye Name: (2S)-3-(1,3-benzoxazol-2-ylsulfanyl)-2-chloro-propanoate CAS Name: (2S)-3-(1,3-benzoxazol-2-ylthio)-2-chloropropanoate IUPAC Name: (2S)-3-(1,3-benzoxazol-2-ylsulfanyl)-2-chloropropanoate Traditional Name: (2S)-3-(1,3-benzoxazol-2-ylthio)-2-chloro-propionate Formula: C10H7ClNO3S- MolecularWeight: 256.68548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC(C(=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SC[C@H](C(=O)[O-])Cl

InChI

InChI=1S/C10H8ClNO3S/c11-6(9(13)14)5-16-10-12-7-3-1-2-4-8(7)15-10/h1-4,6H,5H2,(H,13,14)/p-1/t6-/m1/s1