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

Systemtic Name: (E)-3-(3-fluoranyl-4-methoxy-phenyl)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(3-fluoro-4-methoxy-phenyl)-1-[4-(2-naphthylsulfonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(3-fluoro-4-methoxyphenyl)-1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(3-fluoro-4-methoxyphenyl)-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(3-fluoro-4-methoxy-phenyl)-1-[4-(2-naphthylsulfonyl)piperazino]prop-2-en-1-one Formula: C24H23FN2O4S MolecularWeight: 454.513823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)F

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)F

InChI

InChI=1S/C24H23FN2O4S/c1-31-23-10-6-18(16-22(23)25)7-11-24(28)26-12-14-27(15-13-26)32(29,30)21-9-8-19-4-2-3-5-20(19)17-21/h2-11,16-17H,12-15H2,1H3/b11-7+