[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4,6-dimethyl-pyrimidin-5-yl]methylazanium

Systemtic Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-4,6-dimethyl-pyrimidin-5-yl]methylazanium Openeye Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-4,6-dimethyl-pyrimidin-5-yl]methylammonium CAS Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-4,6-dimethyl-5-pyrimidinyl]methylammonium IUPAC Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-4,6-dimethylpyrimidin-5-yl]methylazanium Traditional Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-4,6-dimethyl-pyrimidin-5-yl]methylammonium Formula: C16H21N4+ MolecularWeight: 269.36474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N2CCC3=CC=CC=C3C2)C)C[NH3+]

Isomeric SMILES

CC1=C(C(=NC(=N1)N2CCC3=CC=CC=C3C2)C)C[NH3+]

InChI

InChI=1S/C16H20N4/c1-11-15(9-17)12(2)19-16(18-11)20-8-7-13-5-3-4-6-14(13)10-20/h3-6H,7-10,17H2,1-2H3/p+1