methyl 2-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-oxidanyl-propanoate Openeye Name: methyl 2-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-hydroxy-propanoate CAS Name: 2-[[3-(1,3-benzothiazol-2-yl)-1-oxopropyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-hydroxypropanoate Traditional Name: 2-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-hydroxy-propionic acid methyl ester Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CCC1=NC2=CC=CC=C2S1

Isomeric SMILES

COC(=O)C(CO)NC(=O)CCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H16N2O4S/c1-20-14(19)10(8-17)15-12(18)6-7-13-16-9-4-2-3-5-11(9)21-13/h2-5,10,17H,6-8H2,1H3,(H,15,18)