(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butanoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butanoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butanoate CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butanoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butanoate Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)butyric acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C23H23NO9S MolecularWeight: 489.49502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCCNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCCNS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H23NO9S/c1-29-16-4-6-18-15(11-23(26)33-20(18)12-16)14-32-22(25)3-2-8-24-34(27,28)17-5-7-19-21(13-17)31-10-9-30-19/h4-7,11-13,24H,2-3,8-10,14H2,1H3