5-(2-methoxyphenoxy)-2-(1-oxidanidylpyridin-1-ium-4-yl)-6-(2-phenylmethoxyethoxy)-1,2-dihydropyrimidine

Systemtic Name: 5-(2-methoxyphenoxy)-2-(1-oxidanidylpyridin-1-ium-4-yl)-6-(2-phenylmethoxyethoxy)-1,2-dihydropyrimidine Openeye Name: 6-(2-benzyloxyethoxy)-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)-1,2-dihydropyrimidine CAS Name: 5-(2-methoxyphenoxy)-2-(1-oxido-4-pyridin-1-iumyl)-6-(2-phenylmethoxyethoxy)-1,2-dihydropyrimidine IUPAC Name: 5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)-6-(2-phenylmethoxyethoxy)-1,2-dihydropyrimidine Traditional Name: 6-(2-benzoxyethoxy)-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)-1,2-dihydropyrimidine Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=C(NC(N=C2)C3=CC=[N+](C=C3)[O-])OCCOCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1OC2=C(NC(N=C2)C3=CC=[N+](C=C3)[O-])OCCOCC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O5/c1-30-21-9-5-6-10-22(21)33-23-17-26-24(20-11-13-28(29)14-12-20)27-25(23)32-16-15-31-18-19-7-3-2-4-8-19/h2-14,17,24,27H,15-16,18H2,1H3