N-[2-acetamido-5-[(1E,3E)-4-(4-nitrophenyl)buta-1,3-dienyl]pyrimidin-4-yl]ethanamide

Systemtic Name: N-[2-acetamido-5-[(1E,3E)-4-(4-nitrophenyl)buta-1,3-dienyl]pyrimidin-4-yl]ethanamide Openeye Name: N-[2-acetamido-5-[(1E,3E)-4-(4-nitrophenyl)buta-1,3-dienyl]pyrimidin-4-yl]acetamide CAS Name: N-[2-acetamido-5-[(1E,3E)-4-(4-nitrophenyl)buta-1,3-dienyl]-4-pyrimidinyl]acetamide IUPAC Name: N-[2-acetamido-5-[(1E,3E)-4-(4-nitrophenyl)buta-1,3-dienyl]pyrimidin-4-yl]acetamide Traditional Name: N-[2-acetamido-5-[(1E,3E)-4-(4-nitrophenyl)buta-1,3-dienyl]pyrimidin-4-yl]acetamide Formula: C18H17N5O4 MolecularWeight: 367.35868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=NC=C1C=CC=CC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CC(=O)NC1=NC(=NC=C1/C=C/C=C/C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C18H17N5O4/c1-12(24)20-17-15(11-19-18(22-17)21-13(2)25)6-4-3-5-14-7-9-16(10-8-14)23(26)27/h3-11H,1-2H3,(H2,19,20,21,22,24,25)/b5-3+,6-4+