(E)-4-(dimethylamino)-3-(3-nitropyridin-2-yl)but-3-en-2-one

Systemtic Name: (E)-4-(dimethylamino)-3-(3-nitropyridin-2-yl)but-3-en-2-one Openeye Name: (E)-4-(dimethylamino)-3-(3-nitro-2-pyridyl)but-3-en-2-one CAS Name: (E)-4-(dimethylamino)-3-(3-nitro-2-pyridinyl)-3-buten-2-one IUPAC Name: (E)-4-(dimethylamino)-3-(3-nitropyridin-2-yl)but-3-en-2-one Traditional Name: (E)-4-(dimethylamino)-3-(3-nitro-2-pyridyl)but-3-en-2-one Formula: C11H13N3O3 MolecularWeight: 235.23922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CN(C)C)C1=C(C=CC=N1)[N+](=O)[O-]

Isomeric SMILES

CC(=O)/C(=C/N(C)C)/C1=C(C=CC=N1)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O3/c1-8(15)9(7-13(2)3)11-10(14(16)17)5-4-6-12-11/h4-7H,1-3H3/b9-7-