2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-9,10-dimethoxy-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-9,10-dimethoxy-6,7-dihydropyrimid[6,1-a]isoquinolin-4-one Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)NC4=CC5=C(C=C4)OCCO5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)NC4=CC5=C(C=C4)OCCO5)OC

InChI

InChI=1S/C22H21N3O5/c1-27-18-9-13-5-6-25-16(15(13)11-19(18)28-2)12-21(24-22(25)26)23-14-3-4-17-20(10-14)30-8-7-29-17/h3-4,9-12H,5-8H2,1-2H3,(H,23,24,26)