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methyl 3-[(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl]sulfanylpropanoate

methyl 3-[(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl]sulfanylpropanoate

Systemtic Name:methyl 3-[(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl]sulfanylpropanoate
Openeye Name:methyl 3-[(1R)-2-(1,3-benzodioxol-5-ylmethylamino)-1-methyl-2-oxo-ethyl]sulfanylpropanoate
CAS Name:3-[[(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl]thio]propanoic acid methyl ester
IUPAC Name:methyl 3-[(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl]sulfanylpropanoate
Traditional Name:3-[[(1R)-2-keto-1-methyl-2-(piperonylamino)ethyl]thio]propionic acid methyl ester
Formula: C15H19NO5S
MolecularWeight: 325.38006
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)SCCC(=O)OC


Isomeric SMILES

C[C@H](C(=O)NCC1=CC2=C(C=C1)OCO2)SCCC(=O)OC


InChI

InChI=1S/C15H19NO5S/c1-10(22-6-5-14(17)19-2)15(18)16-8-11-3-4-12-13(7-11)21-9-20-12/h3-4,7,10H,5-6,8-9H2,1-2H3,(H,16,18)/t10-/m1/s1


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