(E)-3-(3-fluoranyl-4-methoxy-phenyl)-1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(3-fluoranyl-4-methoxy-phenyl)-1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(3-fluoro-4-methoxy-phenyl)-1-[4-(6-nitro-3-pyridyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3-fluoro-4-methoxyphenyl)-1-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3-fluoro-4-methoxyphenyl)-1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(3-fluoro-4-methoxy-phenyl)-1-[4-(6-nitro-3-pyridyl)piperazino]prop-2-en-1-one Formula: C19H19FN4O4 MolecularWeight: 386.376963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C19H19FN4O4/c1-28-17-5-2-14(12-16(17)20)3-7-19(25)23-10-8-22(9-11-23)15-4-6-18(21-13-15)24(26)27/h2-7,12-13H,8-11H2,1H3/b7-3+