5,6,7-trimethoxy-1-(4-phenoxypiperidin-1-yl)phthalazine

Systemtic Name: 5,6,7-trimethoxy-1-(4-phenoxypiperidin-1-yl)phthalazine Openeye Name: 5,6,7-trimethoxy-1-(4-phenoxy-1-piperidyl)phthalazine CAS Name: 5,6,7-trimethoxy-1-(4-phenoxy-1-piperidinyl)phthalazine IUPAC Name: 5,6,7-trimethoxy-1-(4-phenoxypiperidin-1-yl)phthalazine Traditional Name: 5,6,7-trimethoxy-1-(4-phenoxypiperidino)phthalazine Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C=NN=C(C2=C1)N3CCC(CC3)OC4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C2C=NN=C(C2=C1)N3CCC(CC3)OC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C22H25N3O4/c1-26-19-13-17-18(20(27-2)21(19)28-3)14-23-24-22(17)25-11-9-16(10-12-25)29-15-7-5-4-6-8-15/h4-8,13-14,16H,9-12H2,1-3H3