(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 3-(phenylsulfonylamino)propanoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 3-(phenylsulfonylamino)propanoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 3-(benzenesulfonamido)propanoate CAS Name: 3-(benzenesulfonamido)propanoic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 3-(benzenesulfonamido)propanoate Traditional Name: 3-(benzenesulfonamido)propionic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C18H18ClNO6S MolecularWeight: 411.85662

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)CCNS(=O)(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)CCNS(=O)(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C18H18ClNO6S/c19-15-8-13-10-24-12-26-18(13)14(9-15)11-25-17(21)6-7-20-27(22,23)16-4-2-1-3-5-16/h1-5,8-9,20H,6-7,10-12H2