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

Systemtic Name: 9,10-dimethoxy-2-(octan-2-ylamino)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Openeye Name: 9,10-dimethoxy-2-(1-methylheptylamino)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one CAS Name: 9,10-dimethoxy-2-(octan-2-ylamino)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one IUPAC Name: 9,10-dimethoxy-2-(octan-2-ylamino)-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one Traditional Name: 9,10-dimethoxy-2-(1-methylheptylamino)-6,7-dihydropyrimid[6,1-a]isoquinolin-4-one Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC1=NC(=O)N2CCC3=CC(=C(C=C3C2=C1)OC)OC

Isomeric SMILES

CCCCCCC(C)NC1=NC(=O)N2CCC3=CC(=C(C=C3C2=C1)OC)OC

InChI

InChI=1S/C22H31N3O3/c1-5-6-7-8-9-15(2)23-21-14-18-17-13-20(28-4)19(27-3)12-16(17)10-11-25(18)22(26)24-21/h12-15H,5-11H2,1-4H3,(H,23,24,26)