(E)-3-(7-butoxy-2,2-dimethyl-4-propan-2-yl-chromen-6-yl)-2-fluoranyl-but-2-enoate

Systemtic Name: (E)-3-(7-butoxy-2,2-dimethyl-4-propan-2-yl-chromen-6-yl)-2-fluoranyl-but-2-enoate Openeye Name: (E)-3-(7-butoxy-4-isopropyl-2,2-dimethyl-chromen-6-yl)-2-fluoro-but-2-enoate CAS Name: (E)-3-(7-butoxy-2,2-dimethyl-4-propan-2-yl-1-benzopyran-6-yl)-2-fluoro-2-butenoate IUPAC Name: (E)-3-(7-butoxy-2,2-dimethyl-4-propan-2-ylchromen-6-yl)-2-fluorobut-2-enoate Traditional Name: (E)-3-(7-butoxy-4-isopropyl-2,2-dimethyl-chromen-6-yl)-2-fluoro-but-2-enoate Formula: C22H28FO4- MolecularWeight: 375.453723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C2C(=C1)OC(C=C2C(C)C)(C)C)C(=C(C(=O)[O-])F)C

Isomeric SMILES

CCCCOC1=C(C=C2C(=C1)OC(C=C2C(C)C)(C)C)/C(=C(\C(=O)[O-])/F)/C

InChI

InChI=1S/C22H29FO4/c1-7-8-9-26-18-11-19-16(10-15(18)14(4)20(23)21(24)25)17(13(2)3)12-22(5,6)27-19/h10-13H,7-9H2,1-6H3,(H,24,25)/p-1/b20-14+