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

Systemtic Name: 6-chloranyl-5-(2-methoxyphenoxy)-2-(1-oxidanidylpyridin-1-ium-4-yl)-1,2-dihydropyrimidine Openeye Name: 6-chloro-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)-1,2-dihydropyrimidine CAS Name: 6-chloro-5-(2-methoxyphenoxy)-2-(1-oxido-4-pyridin-1-iumyl)-1,2-dihydropyrimidine IUPAC Name: 6-chloro-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)-1,2-dihydropyrimidine Traditional Name: 6-chloro-5-(2-methoxyphenoxy)-2-(1-oxidopyridin-1-ium-4-yl)-1,2-dihydropyrimidine Formula: C16H14ClN3O3 MolecularWeight: 331.75366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClN3O3/c1-22-12-4-2-3-5-13(12)23-14-10-18-16(19-15(14)17)11-6-8-20(21)9-7-11/h2-10,16,19H,1H3