6-[[4-(azocan-1-ylsulfonyl)phenyl]methyl]-4-(trifluoromethyl)chromen-2-one

Systemtic Name: 6-[[4-(azocan-1-ylsulfonyl)phenyl]methyl]-4-(trifluoromethyl)chromen-2-one Openeye Name: 6-[[4-(azocan-1-ylsulfonyl)phenyl]methyl]-4-(trifluoromethyl)chromen-2-one CAS Name: 6-[[4-(1-azocanylsulfonyl)phenyl]methyl]-4-(trifluoromethyl)-1-benzopyran-2-one IUPAC Name: 6-[[4-(azocan-1-ylsulfonyl)phenyl]methyl]-4-(trifluoromethyl)chromen-2-one Traditional Name: 6-[4-(azocan-1-ylsulfonyl)benzyl]-4-(trifluoromethyl)coumarin Formula: C24H24F3NO4S MolecularWeight: 479.51187

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)S(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)OC(=O)C=C4C(F)(F)F

Isomeric SMILES

C1CCCN(CCC1)S(=O)(=O)C2=CC=C(C=C2)CC3=CC4=C(C=C3)OC(=O)C=C4C(F)(F)F

InChI

InChI=1S/C24H24F3NO4S/c25-24(26,27)21-16-23(29)32-22-11-8-18(15-20(21)22)14-17-6-9-19(10-7-17)33(30,31)28-12-4-2-1-3-5-13-28/h6-11,15-16H,1-5,12-14H2