[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoate

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H19NO5S MolecularWeight: 337.39076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)CSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[C@H](C(=O)NC1CC1)OC(=O)CSC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H19NO5S/c1-10(16(19)17-11-2-3-11)22-15(18)9-23-12-4-5-13-14(8-12)21-7-6-20-13/h4-5,8,10-11H,2-3,6-7,9H2,1H3,(H,17,19)/t10-/m1/s1