5-[4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one

Systemtic Name: 5-[4-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-3-methoxy-phenyl]-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Openeye Name: 5-[4-[(2-chloro-6-fluoro-phenyl)methoxy]-3-methoxy-phenyl]-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one CAS Name: 5-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one IUPAC Name: 5-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Traditional Name: 5-[4-(2-chloro-6-fluoro-benzyl)oxy-3-methoxy-phenyl]-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one Formula: C33H29ClFNO3 MolecularWeight: 542.039663

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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)OCC6=C(C=CC=C6Cl)F)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=C(C=C5)OCC6=C(C=CC=C6Cl)F)OC)C(=O)C1)C

InChI

InChI=1S/C33H29ClFNO3/c1-33(2)16-22-30-21-8-5-4-7-19(21)11-13-26(30)36-32(31(22)27(37)17-33)20-12-14-28(29(15-20)38-3)39-18-23-24(34)9-6-10-25(23)35/h4-15,32,36H,16-18H2,1-3H3