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

Systemtic Name: 2-cycloheptyl-4-[3-(2-dimethylaminoethyloxy)-4-methoxy-phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one Openeye Name: 2-cycloheptyl-4-[3-(2-dimethylaminoethyloxy)-4-methoxy-phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one CAS Name: 2-cycloheptyl-4-[3-(2-dimethylaminoethyloxy)-4-methoxyphenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one IUPAC Name: 2-cycloheptyl-4-[3-(2-dimethylaminoethyloxy)-4-methoxyphenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one Traditional Name: 2-cycloheptyl-4-[3-(2-dimethylaminoethyloxy)-4-methoxy-phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one Formula: C26H37N3O3 MolecularWeight: 439.59028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=C(C=CC(=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCCCCC4)OC

Isomeric SMILES

CN(C)CCOC1=C(C=CC(=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCCCCC4)OC

InChI

InChI=1S/C26H37N3O3/c1-28(2)16-17-32-24-18-19(14-15-23(24)31-3)25-21-12-8-9-13-22(21)26(30)29(27-25)20-10-6-4-5-7-11-20/h8-9,14-15,18,20-22H,4-7,10-13,16-17H2,1-3H3