[2,6-bis(trifluoromethyl)phenyl]-(2-methyl-4-pentoxy-phenyl)phosphanyl-methanone

Systemtic Name: [2,6-bis(trifluoromethyl)phenyl]-(2-methyl-4-pentoxy-phenyl)phosphanyl-methanone Openeye Name: [2,6-bis(trifluoromethyl)phenyl]-(2-methyl-4-pentoxy-phenyl)phosphanyl-methanone CAS Name: [2,6-bis(trifluoromethyl)phenyl]-(2-methyl-4-pentoxyphenyl)phosphinomethanone IUPAC Name: [2,6-bis(trifluoromethyl)phenyl]-(2-methyl-4-pentoxyphenyl)phosphanylmethanone Traditional Name: (4-amoxy-2-methyl-phenyl)phosphino-[2,6-bis(trifluoromethyl)phenyl]methanone Formula: C21H21F6O2P MolecularWeight: 450.35442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC(=C(C=C1)PC(=O)C2=C(C=CC=C2C(F)(F)F)C(F)(F)F)C

Isomeric SMILES

CCCCCOC1=CC(=C(C=C1)PC(=O)C2=C(C=CC=C2C(F)(F)F)C(F)(F)F)C

InChI

InChI=1S/C21H21F6O2P/c1-3-4-5-11-29-14-9-10-17(13(2)12-14)30-19(28)18-15(20(22,23)24)7-6-8-16(18)21(25,26)27/h6-10,12,30H,3-5,11H2,1-2H3