1-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-4-ethyl-piperazin-1-ium tetrafluoroborate

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-4-ethyl-piperazin-1-ium tetrafluoroborate Openeye Name: 1-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-4-ethyl-piperazin-1-ium tetrafluoroborate CAS Name: 1-[2-(3,4-dimethoxyphenyl)-1-benzopyran-4-ylidene]-4-ethylpiperazin-1-ium tetrafluoroborate IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-4-ethylpiperazin-1-ium tetrafluoroborate Traditional Name: 1-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]-4-ethyl-piperazin-1-ium tetrafluoroborate Formula: C23H27BF4N2O3 MolecularWeight: 466.276693

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCN1CC[N+](=C2C=C(OC3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC)CC1

Isomeric SMILES

[B-](F)(F)(F)F.CCN1CC[N+](=C2C=C(OC3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC)CC1

InChI

InChI=1S/C23H27N2O3.BF4/c1-4-24-11-13-25(14-12-24)19-16-22(28-20-8-6-5-7-18(19)20)17-9-10-21(26-2)23(15-17)27-3;2-1(3,4)5/h5-10,15-16H,4,11-14H2,1-3H3;/q+1;-1