6-ethyl-8-[(4-methylpiperidin-1-yl)methyl]-7-oxidanyl-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 6-ethyl-8-[(4-methylpiperidin-1-yl)methyl]-7-oxidanyl-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-4-one Openeye Name: 6-ethyl-7-hydroxy-8-[(4-methyl-1-piperidyl)methyl]-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-4-one CAS Name: 6-ethyl-7-hydroxy-8-[(4-methyl-1-piperidinyl)methyl]-3-[(1-phenyl-4-pyrazolyl)oxy]-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 6-ethyl-7-hydroxy-8-[(4-methylpiperidin-1-yl)methyl]-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-4-one Traditional Name: 6-ethyl-7-hydroxy-8-[(4-methylpiperidino)methyl]-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromone Formula: C28H28F3N3O4 MolecularWeight: 527.53483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CN(N=C3)C4=CC=CC=C4)CN5CCC(CC5)C)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CN(N=C3)C4=CC=CC=C4)CN5CCC(CC5)C)O

InChI

InChI=1S/C28H28F3N3O4/c1-3-18-13-21-24(36)26(37-20-14-32-34(15-20)19-7-5-4-6-8-19)27(28(29,30)31)38-25(21)22(23(18)35)16-33-11-9-17(2)10-12-33/h4-8,13-15,17,35H,3,9-12,16H2,1-2H3