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

Systemtic Name: 2-(heptylamino)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Openeye Name: 2-(heptylamino)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one CAS Name: 2-(heptylamino)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one IUPAC Name: 2-(heptylamino)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Traditional Name: 2-(heptylamino)-9,10-dimethoxy-6,7-dihydropyrimid[6,1-a]isoquinolin-4-one Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1=NC(=O)N2CCC3=CC(=C(C=C3C2=C1)OC)OC

Isomeric SMILES

CCCCCCCNC1=NC(=O)N2CCC3=CC(=C(C=C3C2=C1)OC)OC

InChI

InChI=1S/C21H29N3O3/c1-4-5-6-7-8-10-22-20-14-17-16-13-19(27-3)18(26-2)12-15(16)9-11-24(17)21(25)23-20/h12-14H,4-11H2,1-3H3,(H,22,23,25)