2,2-dimethyl-5-[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one

Systemtic Name: 2,2-dimethyl-5-[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Openeye Name: 2,2-dimethyl-5-[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one CAS Name: 2,2-dimethyl-5-[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one IUPAC Name: 2,2-dimethyl-5-[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Traditional Name: 2,2-dimethyl-5-[4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Formula: C32H25F3N2O4 MolecularWeight: 558.54711

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=C(C=C5)OC6=C(C=C(C=C6)C(F)(F)F)[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=C(C=C5)OC6=C(C=C(C=C6)C(F)(F)F)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C32H25F3N2O4/c1-31(2)16-23-28-22-6-4-3-5-18(22)9-13-24(28)36-30(29(23)26(38)17-31)19-7-11-21(12-8-19)41-27-14-10-20(32(33,34)35)15-25(27)37(39)40/h3-15,30,36H,16-17H2,1-2H3