2-[2-[(3,4-dimethylphenoxy)methyl]-6-methyl-pyrimidin-4-yl]ethylazanium

Systemtic Name: 2-[2-[(3,4-dimethylphenoxy)methyl]-6-methyl-pyrimidin-4-yl]ethylazanium Openeye Name: 2-[2-[(3,4-dimethylphenoxy)methyl]-6-methyl-pyrimidin-4-yl]ethylammonium CAS Name: 2-[2-[(3,4-dimethylphenoxy)methyl]-6-methyl-4-pyrimidinyl]ethylammonium IUPAC Name: 2-[2-[(3,4-dimethylphenoxy)methyl]-6-methylpyrimidin-4-yl]ethylazanium Traditional Name: 2-[2-[(3,4-dimethylphenoxy)methyl]-6-methyl-pyrimidin-4-yl]ethylammonium Formula: C16H22N3O+ MolecularWeight: 272.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=NC(=CC(=N2)CC[NH3+])C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=NC(=CC(=N2)CC[NH3+])C)C

InChI

InChI=1S/C16H21N3O/c1-11-4-5-15(8-12(11)2)20-10-16-18-13(3)9-14(19-16)6-7-17/h4-5,8-9H,6-7,10,17H2,1-3H3/p+1