3-(4-chloranyl-3-methyl-phenoxy)-7-oxidanyl-8-(piperidin-1-ylmethyl)-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 3-(4-chloranyl-3-methyl-phenoxy)-7-oxidanyl-8-(piperidin-1-ylmethyl)-2-(trifluoromethyl)chromen-4-one Openeye Name: 3-(4-chloro-3-methyl-phenoxy)-7-hydroxy-8-(1-piperidylmethyl)-2-(trifluoromethyl)chromen-4-one CAS Name: 3-(4-chloro-3-methylphenoxy)-7-hydroxy-8-(1-piperidinylmethyl)-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 3-(4-chloro-3-methylphenoxy)-7-hydroxy-8-(piperidin-1-ylmethyl)-2-(trifluoromethyl)chromen-4-one Traditional Name: 3-(4-chloro-3-methyl-phenoxy)-7-hydroxy-8-(piperidinomethyl)-2-(trifluoromethyl)chromone Formula: C23H21ClF3NO4 MolecularWeight: 467.86535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(OC3=C(C2=O)C=CC(=C3CN4CCCCC4)O)C(F)(F)F)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(OC3=C(C2=O)C=CC(=C3CN4CCCCC4)O)C(F)(F)F)Cl

InChI

InChI=1S/C23H21ClF3NO4/c1-13-11-14(5-7-17(13)24)31-21-19(30)15-6-8-18(29)16(12-28-9-3-2-4-10-28)20(15)32-22(21)23(25,26)27/h5-8,11,29H,2-4,9-10,12H2,1H3