[[5-(3,3-diethoxypropyl)-6-(4-nitrophenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]amino] ethanoate

Systemtic Name: [[5-(3,3-diethoxypropyl)-6-(4-nitrophenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]amino] ethanoate Openeye Name: [[5-(3,3-diethoxypropyl)-6-(4-nitrophenyl)-4-oxo-1H-pyrimidin-2-yl]amino] acetate CAS Name: acetic acid [[5-(3,3-diethoxypropyl)-6-(4-nitrophenyl)-4-oxo-1H-pyrimidin-2-yl]amino] ester IUPAC Name: [[5-(3,3-diethoxypropyl)-6-(4-nitrophenyl)-4-oxo-1H-pyrimidin-2-yl]amino] acetate Traditional Name: acetic acid [[5-(3,3-diethoxypropyl)-4-keto-6-(4-nitrophenyl)-1H-pyrimidin-2-yl]amino] ester Formula: C19H24N4O7 MolecularWeight: 420.41646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CCC1=C(NC(=NC1=O)NOC(=O)C)C2=CC=C(C=C2)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC(CCC1=C(NC(=NC1=O)NOC(=O)C)C2=CC=C(C=C2)[N+](=O)[O-])OCC

InChI

InChI=1S/C19H24N4O7/c1-4-28-16(29-5-2)11-10-15-17(13-6-8-14(9-7-13)23(26)27)20-19(21-18(15)25)22-30-12(3)24/h6-9,16H,4-5,10-11H2,1-3H3,(H2,20,21,22,25)