2,5-dimethyl-7-phenyl-[1,2]oxazolo[2,3-a]pyrimidin-8-ium perchlorate

Systemtic Name: 2,5-dimethyl-7-phenyl-[1,2]oxazolo[2,3-a]pyrimidin-8-ium perchlorate Openeye Name: 2,5-dimethyl-7-phenyl-isoxazolo[2,3-a]pyrimidin-8-ium perchlorate CAS Name: 2,5-dimethyl-7-phenylisoxazolo[2,3-a]pyrimidin-8-ium perchlorate IUPAC Name: 2,5-dimethyl-7-phenyl-[1,2]oxazolo[2,3-a]pyrimidin-8-ium perchlorate Traditional Name: 2,5-dimethyl-7-phenyl-isoxazolo[2,3-a]pyrimidin-8-ium perchlorate Formula: C14H13ClN2O5 MolecularWeight: 324.71642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[N+](O1)C(=CC(=N2)C)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC2=[N+](O1)C(=CC(=N2)C)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C14H13N2O.ClHO4/c1-10-8-13(12-6-4-3-5-7-12)16-14(15-10)9-11(2)17-16;2-1(3,4)5/h3-9H,1-2H3;(H,2,3,4,5)/q+1;/p-1