[4-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-1,3-dioxolan-2-yl]methyl 2-methyl-2-(2-nitrophenyl)propanoate

Systemtic Name: [4-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-1,3-dioxolan-2-yl]methyl 2-methyl-2-(2-nitrophenyl)propanoate Openeye Name: [4-(4-amino-2-oxo-pyrimidin-1-yl)-1,3-dioxolan-2-yl]methyl 2-methyl-2-(2-nitrophenyl)propanoate CAS Name: 2-methyl-2-(2-nitrophenyl)propanoic acid [4-(4-amino-2-oxo-1-pyrimidinyl)-1,3-dioxolan-2-yl]methyl ester IUPAC Name: [4-(4-amino-2-oxopyrimidin-1-yl)-1,3-dioxolan-2-yl]methyl 2-methyl-2-(2-nitrophenyl)propanoate Traditional Name: 2-methyl-2-(2-nitrophenyl)propionic acid [4-(4-amino-2-keto-pyrimidin-1-yl)-1,3-dioxolan-2-yl]methyl ester Formula: C18H20N4O7 MolecularWeight: 404.374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1[N+](=O)[O-])C(=O)OCC2OCC(O2)N3C=CC(=NC3=O)N

Isomeric SMILES

CC(C)(C1=CC=CC=C1[N+](=O)[O-])C(=O)OCC2OCC(O2)N3C=CC(=NC3=O)N

InChI

InChI=1S/C18H20N4O7/c1-18(2,11-5-3-4-6-12(11)22(25)26)16(23)28-10-15-27-9-14(29-15)21-8-7-13(19)20-17(21)24/h3-8,14-15H,9-10H2,1-2H3,(H2,19,20,24)