(4-morpholin-4-ylsulfonylphenyl)methyl 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: (4-morpholin-4-ylsulfonylphenyl)methyl 2-oxidanylidenechromene-3-carboxylate Openeye Name: (4-morpholinosulfonylphenyl)methyl 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid [4-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (4-morpholin-4-ylsulfonylphenyl)methyl 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid (4-morpholinosulfonylbenzyl) ester Formula: C21H19NO7S MolecularWeight: 429.44306

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)COC(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)COC(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H19NO7S/c23-20(18-13-16-3-1-2-4-19(16)29-21(18)24)28-14-15-5-7-17(8-6-15)30(25,26)22-9-11-27-12-10-22/h1-8,13H,9-12,14H2