(3-morpholin-4-ylsulfonylphenyl)methyl 6-chloranyl-2H-chromene-3-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 6-chloranyl-2H-chromene-3-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 6-chloro-2H-chromene-3-carboxylate CAS Name: 6-chloro-2H-1-benzopyran-3-carboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 6-chloro-2H-chromene-3-carboxylate Traditional Name: 6-chloro-2H-chromene-3-carboxylic acid (3-morpholinosulfonylbenzyl) ester Formula: C21H20ClNO6S MolecularWeight: 449.9046

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)C3=CC4=C(C=CC(=C4)Cl)OC3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)C3=CC4=C(C=CC(=C4)Cl)OC3

InChI

InChI=1S/C21H20ClNO6S/c22-18-4-5-20-16(12-18)11-17(14-28-20)21(24)29-13-15-2-1-3-19(10-15)30(25,26)23-6-8-27-9-7-23/h1-5,10-12H,6-9,13-14H2