(E)-1-(4-cyclopropylcarbonylpiperazin-1-yl)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-cyclopropylcarbonylpiperazin-1-yl)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-3-(3-fluoro-4-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-3-(3-fluoro-4-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-3-(3-fluoro-4-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(cyclopropanecarbonyl)piperazino]-3-(3-fluoro-4-methoxy-phenyl)prop-2-en-1-one Formula: C18H21FN2O3 MolecularWeight: 332.369343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCN(CC2)C(=O)C3CC3)F

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCN(CC2)C(=O)C3CC3)F

InChI

InChI=1S/C18H21FN2O3/c1-24-16-6-2-13(12-15(16)19)3-7-17(22)20-8-10-21(11-9-20)18(23)14-4-5-14/h2-3,6-7,12,14H,4-5,8-11H2,1H3/b7-3+