5-[(9,10-dimethoxy-4-oxidanylidene-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]pentylazanium

Systemtic Name: 5-[(9,10-dimethoxy-4-oxidanylidene-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]pentylazanium Openeye Name: 5-[(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]pentylammonium CAS Name: 5-[(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]pentylammonium IUPAC Name: 5-[(9,10-dimethoxy-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinolin-2-yl)amino]pentylazanium Traditional Name: 5-[(4-keto-9,10-dimethoxy-6,7-dihydropyrimid[6,1-a]isoquinolin-2-yl)amino]pentylammonium Formula: C19H27N4O3+ MolecularWeight: 359.44268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N4O3/c1-25-16-10-13-6-9-23-15(14(13)11-17(16)26-2)12-18(22-19(23)24)21-8-5-3-4-7-20/h10-12H,3-9,20H2,1-2H3,(H,21,22,24)/p+1