6-[[4-(4-pyrrolidin-1-ylpiperidin-1-yl)sulfonylphenyl]methyl]-4-(trifluoromethyl)chromen-2-one

Systemtic Name: 6-[[4-(4-pyrrolidin-1-ylpiperidin-1-yl)sulfonylphenyl]methyl]-4-(trifluoromethyl)chromen-2-one Openeye Name: 6-[[4-[(4-pyrrolidin-1-yl-1-piperidyl)sulfonyl]phenyl]methyl]-4-(trifluoromethyl)chromen-2-one CAS Name: 6-[[4-[[4-(1-pyrrolidinyl)-1-piperidinyl]sulfonyl]phenyl]methyl]-4-(trifluoromethyl)-1-benzopyran-2-one IUPAC Name: 6-[[4-(4-pyrrolidin-1-ylpiperidin-1-yl)sulfonylphenyl]methyl]-4-(trifluoromethyl)chromen-2-one Traditional Name: 6-[4-(4-pyrrolidinopiperidino)sulfonylbenzyl]-4-(trifluoromethyl)coumarin Formula: C26H27F3N2O4S MolecularWeight: 520.56379

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)CC4=CC5=C(C=C4)OC(=O)C=C5C(F)(F)F

Isomeric SMILES

C1CCN(C1)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)CC4=CC5=C(C=C4)OC(=O)C=C5C(F)(F)F

InChI

InChI=1S/C26H27F3N2O4S/c27-26(28,29)23-17-25(32)35-24-8-5-19(16-22(23)24)15-18-3-6-21(7-4-18)36(33,34)31-13-9-20(10-14-31)30-11-1-2-12-30/h3-8,16-17,20H,1-2,9-15H2