5,6,7-trimethoxy-1-(3-phenylpiperidin-1-yl)phthalazine

Systemtic Name: 5,6,7-trimethoxy-1-(3-phenylpiperidin-1-yl)phthalazine Openeye Name: 5,6,7-trimethoxy-1-(3-phenyl-1-piperidyl)phthalazine CAS Name: 5,6,7-trimethoxy-1-(3-phenyl-1-piperidinyl)phthalazine IUPAC Name: 5,6,7-trimethoxy-1-(3-phenylpiperidin-1-yl)phthalazine Traditional Name: 5,6,7-trimethoxy-1-(3-phenylpiperidino)phthalazine Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C=NN=C(C2=C1)N3CCCC(C3)C4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C2C=NN=C(C2=C1)N3CCCC(C3)C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C22H25N3O3/c1-26-19-12-17-18(20(27-2)21(19)28-3)13-23-24-22(17)25-11-7-10-16(14-25)15-8-5-4-6-9-15/h4-6,8-9,12-13,16H,7,10-11,14H2,1-3H3