1,3-bis(phenylmethyl)pyrimidin-1-ium-2-one

Systemtic Name: 1,3-bis(phenylmethyl)pyrimidin-1-ium-2-one Openeye Name: 1,3-dibenzylpyrimidin-1-ium-2-one CAS Name: 1,3-bis(phenylmethyl)-2-pyrimidin-1-iumone IUPAC Name: 1,3-dibenzylpyrimidin-1-ium-2-one Traditional Name: 1,3-dibenzylpyrimidin-1-ium-2-one Formula: C18H17N2O+ MolecularWeight: 277.34038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC=[N+](C2=O)CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC=[N+](C2=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H17N2O/c21-18-19(14-16-8-3-1-4-9-16)12-7-13-20(18)15-17-10-5-2-6-11-17/h1-13H,14-15H2/q+1