1-ethyl-4-[2-(4-methoxyphenyl)chromen-4-ylidene]piperazin-4-ium tetrafluoroborate

Systemtic Name: 1-ethyl-4-[2-(4-methoxyphenyl)chromen-4-ylidene]piperazin-4-ium tetrafluoroborate Openeye Name: 1-ethyl-4-[2-(4-methoxyphenyl)chromen-4-ylidene]piperazin-4-ium tetrafluoroborate CAS Name: 1-ethyl-4-[2-(4-methoxyphenyl)-1-benzopyran-4-ylidene]piperazin-4-ium tetrafluoroborate IUPAC Name: 1-ethyl-4-[2-(4-methoxyphenyl)chromen-4-ylidene]piperazin-4-ium tetrafluoroborate Traditional Name: 1-ethyl-4-[2-(4-methoxyphenyl)chromen-4-ylidene]piperazin-4-ium tetrafluoroborate Formula: C22H25BF4N2O2 MolecularWeight: 436.250713

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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)CC1

Isomeric SMILES

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

InChI

InChI=1S/C22H25N2O2.BF4/c1-3-23-12-14-24(15-13-23)20-16-22(17-8-10-18(25-2)11-9-17)26-21-7-5-4-6-19(20)21;2-1(3,4)5/h4-11,16H,3,12-15H2,1-2H3;/q+1;-1