N-[6-methyl-5-[4-(4-nitrophenyl)but-3-enyl]-4-oxidanylidene-1H-pyrimidin-2-yl]ethanamide

Systemtic Name: N-[6-methyl-5-[4-(4-nitrophenyl)but-3-enyl]-4-oxidanylidene-1H-pyrimidin-2-yl]ethanamide Openeye Name: N-[6-methyl-5-[4-(4-nitrophenyl)but-3-enyl]-4-oxo-1H-pyrimidin-2-yl]acetamide CAS Name: N-[6-methyl-5-[4-(4-nitrophenyl)but-3-enyl]-4-oxo-1H-pyrimidin-2-yl]acetamide IUPAC Name: N-[6-methyl-5-[4-(4-nitrophenyl)but-3-enyl]-4-oxo-1H-pyrimidin-2-yl]acetamide Traditional Name: N-[4-keto-6-methyl-5-[4-(4-nitrophenyl)but-3-enyl]-1H-pyrimidin-2-yl]acetamide Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NC(=O)C)CCC=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NC(=O)C)CCC=CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4/c1-11-15(16(23)20-17(18-11)19-12(2)22)6-4-3-5-13-7-9-14(10-8-13)21(24)25/h3,5,7-10H,4,6H2,1-2H3,(H2,18,19,20,22,23)