methyl 5-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]furan-2-carboxylate CAS Name: 5-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]furan-2-carboxylate Traditional Name: 5-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]methyl]furan-2-carboxylic acid methyl ester Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CNCC2COC3=CC=CC=C3O2

Isomeric SMILES

COC(=O)C1=CC=C(O1)CNC[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C16H17NO5/c1-19-16(18)15-7-6-11(21-15)8-17-9-12-10-20-13-4-2-3-5-14(13)22-12/h2-7,12,17H,8-10H2,1H3/t12-/m0/s1