2-[(9,10-dimethoxy-4-oxidanylidene-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]ethylazanium

Systemtic Name: 2-[(9,10-dimethoxy-4-oxidanylidene-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]ethylazanium Openeye Name: 2-[(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]ethylammonium CAS Name: 2-[(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]ethylammonium IUPAC Name: 2-[(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]ethylazanium Traditional Name: 2-[(4-keto-9,10-dimethoxy-6,7-dihydropyrimid[6,1-a]isoquinolin-2-yl)amino]ethylammonium Formula: C16H21N4O3+ MolecularWeight: 317.36294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)NCC[NH3+])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN3C2=CC(=NC3=O)NCC[NH3+])OC

InChI

InChI=1S/C16H20N4O3/c1-22-13-7-10-3-6-20-12(11(10)8-14(13)23-2)9-15(18-5-4-17)19-16(20)21/h7-9H,3-6,17H2,1-2H3,(H,18,19,21)/p+1