9,10-dimethoxy-2-[2-(4-nonanoylpiperazin-1-yl)ethylamino]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one

Systemtic Name: 9,10-dimethoxy-2-[2-(4-nonanoylpiperazin-1-yl)ethylamino]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Openeye Name: 9,10-dimethoxy-2-[2-(4-nonanoylpiperazin-1-yl)ethylamino]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one CAS Name: 9,10-dimethoxy-2-[2-[4-(1-oxononyl)-1-piperazinyl]ethylamino]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one IUPAC Name: 9,10-dimethoxy-2-[2-(4-nonanoylpiperazin-1-yl)ethylamino]-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Traditional Name: 9,10-dimethoxy-2-[2-(4-pelargonylpiperazino)ethylamino]-6,7-dihydropyrimid[6,1-a]isoquinolin-4-one Formula: C29H43N5O4 MolecularWeight: 525.68282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)N1CCN(CC1)CCNC2=NC(=O)N3CCC4=CC(=C(C=C4C3=C2)OC)OC

Isomeric SMILES

CCCCCCCCC(=O)N1CCN(CC1)CCNC2=NC(=O)N3CCC4=CC(=C(C=C4C3=C2)OC)OC

InChI

InChI=1S/C29H43N5O4/c1-4-5-6-7-8-9-10-28(35)33-17-15-32(16-18-33)14-12-30-27-21-24-23-20-26(38-3)25(37-2)19-22(23)11-13-34(24)29(36)31-27/h19-21H,4-18H2,1-3H3,(H,30,31,36)