3-[3,6-bis(trifluoromethyl)phenanthren-9-yl]-3-oxidanyl-propanenitrile

Systemtic Name: 3-[3,6-bis(trifluoromethyl)phenanthren-9-yl]-3-oxidanyl-propanenitrile Openeye Name: 3-[3,6-bis(trifluoromethyl)-9-phenanthryl]-3-hydroxy-propanenitrile CAS Name: 3-[3,6-bis(trifluoromethyl)-9-phenanthrenyl]-3-hydroxypropanenitrile IUPAC Name: 3-[3,6-bis(trifluoromethyl)phenanthren-9-yl]-3-hydroxypropanenitrile Traditional Name: 3-[3,6-bis(trifluoromethyl)-9-phenanthryl]-3-hydroxy-propionitrile Formula: C19H11F6NO MolecularWeight: 383.287159

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C3C=C(C=CC3=C(C=C21)C(CC#N)O)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC(=CC2=C3C=C(C=CC3=C(C=C21)C(CC#N)O)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H11F6NO/c20-18(21,22)11-2-1-10-7-16(17(27)5-6-26)13-4-3-12(19(23,24)25)9-15(13)14(10)8-11/h1-4,7-9,17,27H,5H2