(Z)-4-(3-nitrophenyl)-3-pyrimidin-5-yl-but-3-en-2-one

Systemtic Name: (Z)-4-(3-nitrophenyl)-3-pyrimidin-5-yl-but-3-en-2-one Openeye Name: (Z)-4-(3-nitrophenyl)-3-pyrimidin-5-yl-but-3-en-2-one CAS Name: (Z)-4-(3-nitrophenyl)-3-(5-pyrimidinyl)-3-buten-2-one IUPAC Name: (Z)-4-(3-nitrophenyl)-3-pyrimidin-5-ylbut-3-en-2-one Traditional Name: (Z)-4-(3-nitrophenyl)-3-(5-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=CN=CN=C2

Isomeric SMILES

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

InChI

InChI=1S/C14H11N3O3/c1-10(18)14(12-7-15-9-16-8-12)6-11-3-2-4-13(5-11)17(19)20/h2-9H,1H3/b14-6+