1,2-dimethyl-5-(naphthalen-2-yloxymethyl)pyrimidin-1-ium-4-amine perchlorate

Systemtic Name: 1,2-dimethyl-5-(naphthalen-2-yloxymethyl)pyrimidin-1-ium-4-amine perchlorate Openeye Name: 1,2-dimethyl-5-(2-naphthyloxymethyl)pyrimidin-1-ium-4-amine perchlorate CAS Name: 1,2-dimethyl-5-(2-naphthalenyloxymethyl)-4-pyrimidin-1-iumamine perchlorate IUPAC Name: 1,2-dimethyl-5-(naphthalen-2-yloxymethyl)pyrimidin-1-ium-4-amine perchlorate Traditional Name: [1,2-dimethyl-5-(2-naphthoxymethyl)pyrimidin-1-ium-4-yl]amine perchlorate Formula: C17H18ClN3O5 MolecularWeight: 379.79492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C(=N1)N)COC2=CC3=CC=CC=C3C=C2)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=[N+](C=C(C(=N1)N)COC2=CC3=CC=CC=C3C=C2)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C17H17N3O.ClHO4/c1-12-19-17(18)15(10-20(12)2)11-21-16-8-7-13-5-3-4-6-14(13)9-16;2-1(3,4)5/h3-10,18H,11H2,1-2H3;(H,2,3,4,5)