6-methyl-5-(methylperoxymethyl)-4-(3-nitrophenyl)-2-pyridin-2-yl-1,4-dihydropyrimidine

Systemtic Name: 6-methyl-5-(methylperoxymethyl)-4-(3-nitrophenyl)-2-pyridin-2-yl-1,4-dihydropyrimidine Openeye Name: 6-methyl-5-(methylperoxymethyl)-4-(3-nitrophenyl)-2-(2-pyridyl)-1,4-dihydropyrimidine CAS Name: 6-methyl-5-(methyldioxymethyl)-4-(3-nitrophenyl)-2-(2-pyridinyl)-1,4-dihydropyrimidine IUPAC Name: 6-methyl-5-(methylperoxymethyl)-4-(3-nitrophenyl)-2-pyridin-2-yl-1,4-dihydropyrimidine Traditional Name: 6-methyl-5-(methylperoxymethyl)-4-(3-nitrophenyl)-2-(2-pyridyl)-1,4-dihydropyrimidine Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)C2=CC=CC=N2)C3=CC(=CC=C3)[N+](=O)[O-])COOC

Isomeric SMILES

CC1=C(C(N=C(N1)C2=CC=CC=N2)C3=CC(=CC=C3)[N+](=O)[O-])COOC

InChI

InChI=1S/C18H18N4O4/c1-12-15(11-26-25-2)17(13-6-5-7-14(10-13)22(23)24)21-18(20-12)16-8-3-4-9-19-16/h3-10,17H,11H2,1-2H3,(H,20,21)