8-[4-(pyridin-3-ylmethyl)phthalazin-1-yl]-1,4-dioxa-8-azaspiro[4.5]decane

Systemtic Name: 8-[4-(pyridin-3-ylmethyl)phthalazin-1-yl]-1,4-dioxa-8-azaspiro[4.5]decane Openeye Name: 8-[4-(3-pyridylmethyl)phthalazin-1-yl]-1,4-dioxa-8-azaspiro[4.5]decane CAS Name: 8-[4-(3-pyridinylmethyl)-1-phthalazinyl]-1,4-dioxa-8-azaspiro[4.5]decane IUPAC Name: 8-[4-(pyridin-3-ylmethyl)phthalazin-1-yl]-1,4-dioxa-8-azaspiro[4.5]decane Traditional Name: 8-[4-(3-pyridylmethyl)phthalazin-1-yl]-1,4-dioxa-8-azaspiro[4.5]decane Formula: C21H22N4O2 MolecularWeight: 362.42498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12OCCO2)C3=NN=C(C4=CC=CC=C43)CC5=CN=CC=C5

Isomeric SMILES

C1CN(CCC12OCCO2)C3=NN=C(C4=CC=CC=C43)CC5=CN=CC=C5

InChI

InChI=1S/C21H22N4O2/c1-2-6-18-17(5-1)19(14-16-4-3-9-22-15-16)23-24-20(18)25-10-7-21(8-11-25)26-12-13-27-21/h1-6,9,15H,7-8,10-14H2