4-[3-(2-bromoethyloxy)-4-methoxy-phenyl]-2-cycloheptyl-4a,5,8,8a-tetrahydrophthalazin-1-one

Systemtic Name: 4-[3-(2-bromoethyloxy)-4-methoxy-phenyl]-2-cycloheptyl-4a,5,8,8a-tetrahydrophthalazin-1-one Openeye Name: 4-[3-(2-bromoethoxy)-4-methoxy-phenyl]-2-cycloheptyl-4a,5,8,8a-tetrahydrophthalazin-1-one CAS Name: 4-[3-(2-bromoethoxy)-4-methoxyphenyl]-2-cycloheptyl-4a,5,8,8a-tetrahydrophthalazin-1-one IUPAC Name: 4-[3-(2-bromoethoxy)-4-methoxyphenyl]-2-cycloheptyl-4a,5,8,8a-tetrahydrophthalazin-1-one Traditional Name: 4-[3-(2-bromoethoxy)-4-methoxy-phenyl]-2-cycloheptyl-4a,5,8,8a-tetrahydrophthalazin-1-one Formula: C24H31BrN2O3 MolecularWeight: 475.41854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCCCCC4)OCCBr

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCCCCC4)OCCBr

InChI

InChI=1S/C24H31BrN2O3/c1-29-21-13-12-17(16-22(21)30-15-14-25)23-19-10-6-7-11-20(19)24(28)27(26-23)18-8-4-2-3-5-9-18/h6-7,12-13,16,18-20H,2-5,8-11,14-15H2,1H3