(6-ethyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonate

Systemtic Name: (6-ethyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-oxidanylidene-3,4-dihydro-1H-quinoline-6-sulfonate Openeye Name: (6-ethyl-4-methyl-2-oxo-chromen-7-yl) 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonate CAS Name: 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonic acid (6-ethyl-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (6-ethyl-4-methyl-2-oxochromen-7-yl) 2-oxo-3,4-dihydro-1H-quinoline-6-sulfonate Traditional Name: 2-keto-3,4-dihydro-1H-quinoline-6-sulfonic acid (6-ethyl-2-keto-4-methyl-chromen-7-yl) ester Formula: C21H19NO6S MolecularWeight: 413.44366

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC4

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C)OS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC4

InChI

InChI=1S/C21H19NO6S/c1-3-13-10-16-12(2)8-21(24)27-19(16)11-18(13)28-29(25,26)15-5-6-17-14(9-15)4-7-20(23)22-17/h5-6,8-11H,3-4,7H2,1-2H3,(H,22,23)