(E)-3-(5-nitrofuran-2-yl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(5-nitrofuran-2-yl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(5-nitro-2-furyl)-1-[4-(3-pyridylmethyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(5-nitro-2-furanyl)-1-[4-(3-pyridinylmethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(5-nitrofuran-2-yl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(5-nitro-2-furyl)-1-[4-(3-pyridylmethyl)piperazino]prop-2-en-1-one Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)C(=O)C=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)C(=O)/C=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4/c22-16(5-3-15-4-6-17(25-15)21(23)24)20-10-8-19(9-11-20)13-14-2-1-7-18-12-14/h1-7,12H,8-11,13H2/b5-3+