(Z)-4-(3-nitrophenyl)-3-pyrimidin-2-yl-but-3-en-2-one

Systemtic Name: (Z)-4-(3-nitrophenyl)-3-pyrimidin-2-yl-but-3-en-2-one Openeye Name: (Z)-4-(3-nitrophenyl)-3-pyrimidin-2-yl-but-3-en-2-one CAS Name: (Z)-4-(3-nitrophenyl)-3-(2-pyrimidinyl)-3-buten-2-one IUPAC Name: (Z)-4-(3-nitrophenyl)-3-pyrimidin-2-ylbut-3-en-2-one Traditional Name: (Z)-4-(3-nitrophenyl)-3-(2-pyrimidyl)but-3-en-2-one Formula: C14H11N3O3 MolecularWeight: 269.25544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])C2=NC=CC=N2

Isomeric SMILES

CC(=O)/C(=C\C1=CC(=CC=C1)[N+](=O)[O-])/C2=NC=CC=N2

InChI

InChI=1S/C14H11N3O3/c1-10(18)13(14-15-6-3-7-16-14)9-11-4-2-5-12(8-11)17(19)20/h2-9H,1H3/b13-9+