(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-methyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 4-methyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 4-methyl-3-morpholinosulfonyl-benzoate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)benzoic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 4-methyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methyl-3-morpholinosulfonyl-benzoic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C23H22ClNO7S MolecularWeight: 491.94128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)Cl)C)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)Cl)C)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H22ClNO7S/c1-14-3-4-16(10-21(14)33(28,29)25-5-7-30-8-6-25)23(27)31-13-17-11-22(26)32-20-9-15(2)19(24)12-18(17)20/h3-4,9-12H,5-8,13H2,1-2H3