methyl 3-[(6-azanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonyl]propanoate

Systemtic Name: methyl 3-[(6-azanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonyl]propanoate Openeye Name: methyl 3-[(6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonyl]propanoate CAS Name: 3-[(6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonyl]propanoate Traditional Name: 3-[(6-amino-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfonyl]propionic acid methyl ester Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCS(=O)(=O)CC1=CC2=C(C=C1N)OCCO2

Isomeric SMILES

COC(=O)CCS(=O)(=O)CC1=CC2=C(C=C1N)OCCO2

InChI

InChI=1S/C13H17NO6S/c1-18-13(15)2-5-21(16,17)8-9-6-11-12(7-10(9)14)20-4-3-19-11/h6-7H,2-5,8,14H2,1H3