2-[6-(6-azanylhexylamino)hexylamino]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one

Systemtic Name: 2-[6-(6-azanylhexylamino)hexylamino]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Openeye Name: 2-[6-(6-aminohexylamino)hexylamino]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one CAS Name: 2-[6-(6-aminohexylamino)hexylamino]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one IUPAC Name: 2-[6-(6-aminohexylamino)hexylamino]-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Traditional Name: 2-[6-(6-aminohexylamino)hexylamino]-9,10-dimethoxy-6,7-dihydropyrimid[6,1-a]isoquinolin-4-one Formula: C26H41N5O3 MolecularWeight: 471.63544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)NCCCCCCNCCCCCCN)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)NCCCCCCNCCCCCCN)OC

InChI

InChI=1S/C26H41N5O3/c1-33-23-17-20-11-16-31-22(21(20)18-24(23)34-2)19-25(30-26(31)32)29-15-10-6-5-9-14-28-13-8-4-3-7-12-27/h17-19,28H,3-16,27H2,1-2H3,(H,29,30,32)