methyl 2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-oxidanylidene-ethanoate

Systemtic Name: methyl 2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-oxidanylidene-ethanoate Openeye Name: methyl 2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-oxo-acetate CAS Name: 2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-oxoacetic acid methyl ester IUPAC Name: methyl 2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-oxoacetate Traditional Name: 2-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-2-keto-acetic acid methyl ester Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)NCC1COC2=CC=CC=C2O1

Isomeric SMILES

COC(=O)C(=O)NC[C@H]1COC2=CC=CC=C2O1

InChI

InChI=1S/C12H13NO5/c1-16-12(15)11(14)13-6-8-7-17-9-4-2-3-5-10(9)18-8/h2-5,8H,6-7H2,1H3,(H,13,14)/t8-/m0/s1