(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-[(4-ethanoylphenyl)sulfonylamino]propanoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-[(4-ethanoylphenyl)sulfonylamino]propanoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 3-[(4-acetylphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-acetylphenyl)sulfonylamino]propanoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 3-[(4-acetylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-acetylphenyl)sulfonylamino]propionic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C23H23NO7S MolecularWeight: 457.49622

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C23H23NO7S/c1-3-16-4-9-20-18(13-23(27)31-21(20)12-16)14-30-22(26)10-11-24-32(28,29)19-7-5-17(6-8-19)15(2)25/h4-9,12-13,24H,3,10-11,14H2,1-2H3