(E)-1-[4-(4-ethylpiperazin-1-yl)-3-fluoranyl-phenyl]-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(4-ethylpiperazin-1-yl)-3-fluoranyl-phenyl]-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(4-ethylpiperazin-1-yl)-3-fluoro-phenyl]-3-(4-isopropyl-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-1-[4-(4-ethyl-1-piperazinyl)-3-fluorophenyl]-3-(3-nitro-4-propan-2-ylphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(4-ethylpiperazin-1-yl)-3-fluorophenyl]-3-(3-nitro-4-propan-2-ylphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(4-ethylpiperazino)-3-fluoro-phenyl]-3-(4-isopropyl-3-nitro-phenyl)prop-2-en-1-one Formula: C24H28FN3O3 MolecularWeight: 425.495823

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)C=CC3=CC(=C(C=C3)C(C)C)[N+](=O)[O-])F

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)/C=C/C3=CC(=C(C=C3)C(C)C)[N+](=O)[O-])F

InChI

InChI=1S/C24H28FN3O3/c1-4-26-11-13-27(14-12-26)22-9-7-19(16-21(22)25)24(29)10-6-18-5-8-20(17(2)3)23(15-18)28(30)31/h5-10,15-17H,4,11-14H2,1-3H3/b10-6+