(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-ethoxyphenyl)sulfonylamino]propanoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate Traditional Name: 3-(p-phenetylsulfonylamino)propionic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C22H23NO8S MolecularWeight: 461.48492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C22H23NO8S/c1-3-29-16-4-7-18(8-5-16)32(26,27)23-11-10-21(24)30-14-15-12-22(25)31-20-13-17(28-2)6-9-19(15)20/h4-9,12-13,23H,3,10-11,14H2,1-2H3