(6-methyl-2-phenyl-chromen-4-ylidene)-[4-(2-methylpropanoyloxy)phenyl]azanium tetrafluoroborate

Systemtic Name: (6-methyl-2-phenyl-chromen-4-ylidene)-[4-(2-methylpropanoyloxy)phenyl]azanium tetrafluoroborate Openeye Name: (6-methyl-2-phenyl-chromen-4-ylidene)-[4-(2-methylpropanoyloxy)phenyl]ammonium tetrafluoroborate CAS Name: [4-(2-methyl-1-oxopropoxy)phenyl]-(6-methyl-2-phenyl-1-benzopyran-4-ylidene)ammonium tetrafluoroborate IUPAC Name: (6-methyl-2-phenylchromen-4-ylidene)-[4-(2-methylpropanoyloxy)phenyl]azanium tetrafluoroborate Traditional Name: (4-isobutyryloxyphenyl)-(6-methyl-2-phenyl-chromen-4-ylidene)ammonium tetrafluoroborate Formula: C26H24BF4NO3 MolecularWeight: 485.278273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=CC2=C(C=C1)OC(=CC2=[NH+]C3=CC=C(C=C3)OC(=O)C(C)C)C4=CC=CC=C4

Isomeric SMILES

[B-](F)(F)(F)F.CC1=CC2=C(C=C1)OC(=CC2=[NH+]C3=CC=C(C=C3)OC(=O)C(C)C)C4=CC=CC=C4

InChI

InChI=1S/C26H23NO3.BF4/c1-17(2)26(28)29-21-12-10-20(11-13-21)27-23-16-25(19-7-5-4-6-8-19)30-24-14-9-18(3)15-22(23)24;2-1(3,4)5/h4-17H,1-3H3;/q;-1/p+1