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

Systemtic Name: 2-cycloheptyl-4-[3-[4-(dimethylamino)butoxy]-4-methoxy-phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one Openeye Name: 2-cycloheptyl-4-[3-[4-(dimethylamino)butoxy]-4-methoxy-phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one CAS Name: 2-cycloheptyl-4-[3-[4-(dimethylamino)butoxy]-4-methoxyphenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one IUPAC Name: 2-cycloheptyl-4-[3-[4-(dimethylamino)butoxy]-4-methoxyphenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one Traditional Name: 2-cycloheptyl-4-[3-[4-(dimethylamino)butoxy]-4-methoxy-phenyl]-4a,5,8,8a-tetrahydrophthalazin-1-one Formula: C28H41N3O3 MolecularWeight: 467.64344

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCOC1=C(C=CC(=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCCCCC4)OC

Isomeric SMILES

CN(C)CCCCOC1=C(C=CC(=C1)C2=NN(C(=O)C3C2CC=CC3)C4CCCCCC4)OC

InChI

InChI=1S/C28H41N3O3/c1-30(2)18-10-11-19-34-26-20-21(16-17-25(26)33-3)27-23-14-8-9-15-24(23)28(32)31(29-27)22-12-6-4-5-7-13-22/h8-9,16-17,20,22-24H,4-7,10-15,18-19H2,1-3H3