[4-(4-fluorophenyl)-4-oxidanylidene-butyl] (E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] (E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] (E)-3-(3-chlorobenzothiophen-2-yl)prop-2-enoate CAS Name: (E)-3-(3-chloro-1-benzothiophen-2-yl)-2-propenoic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] (E)-3-(3-chloro-1-benzothiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(3-chlorobenzothiophen-2-yl)acrylic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C21H16ClFO3S MolecularWeight: 402.866343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C=CC(=O)OCCCC(=O)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)/C=C/C(=O)OCCCC(=O)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C21H16ClFO3S/c22-21-16-4-1-2-6-18(16)27-19(21)11-12-20(25)26-13-3-5-17(24)14-7-9-15(23)10-8-14/h1-2,4,6-12H,3,5,13H2/b12-11+