[6-(4-ethoxy-2-oxidanylidene-pyrimidin-1-yl)-3-(4-nitrophenyl)carbonyloxy-oxan-2-yl]methyl 4-nitrobenzoate

Systemtic Name: [6-(4-ethoxy-2-oxidanylidene-pyrimidin-1-yl)-3-(4-nitrophenyl)carbonyloxy-oxan-2-yl]methyl 4-nitrobenzoate Openeye Name: [6-(4-ethoxy-2-oxo-pyrimidin-1-yl)-3-(4-nitrobenzoyl)oxy-tetrahydropyran-2-yl]methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [6-(4-ethoxy-2-oxo-1-pyrimidinyl)-3-[(4-nitrophenyl)-oxomethoxy]-2-oxanyl]methyl ester IUPAC Name: [6-(4-ethoxy-2-oxopyrimidin-1-yl)-3-(4-nitrobenzoyl)oxyoxan-2-yl]methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [6-(4-ethoxy-2-keto-pyrimidin-1-yl)-3-(4-nitrobenzoyl)oxy-tetrahydropyran-2-yl]methyl ester Formula: C26H24N4O11 MolecularWeight: 568.48896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=O)N(C=C1)C2CCC(C(O2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=NC(=O)N(C=C1)C2CCC(C(O2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H24N4O11/c1-2-38-22-13-14-28(26(33)27-22)23-12-11-20(41-25(32)17-5-9-19(10-6-17)30(36)37)21(40-23)15-39-24(31)16-3-7-18(8-4-16)29(34)35/h3-10,13-14,20-21,23H,2,11-12,15H2,1H3