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

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(3-chlorophenyl)sulfonylamino]propanoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 3-[(3-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(3-chlorophenyl)sulfonylamino]propionic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C21H20ClNO6S MolecularWeight: 449.9046

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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(=CC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClNO6S/c1-2-14-6-7-18-15(11-21(25)29-19(18)10-14)13-28-20(24)8-9-23-30(26,27)17-5-3-4-16(22)12-17/h3-7,10-12,23H,2,8-9,13H2,1H3