[6-ethyl-2-(4-methoxyphenyl)chromen-4-ylidene]-(3-oxidanylpropyl)azanium tetrafluoroborate

Systemtic Name: [6-ethyl-2-(4-methoxyphenyl)chromen-4-ylidene]-(3-oxidanylpropyl)azanium tetrafluoroborate Openeye Name: [6-ethyl-2-(4-methoxyphenyl)chromen-4-ylidene]-(3-hydroxypropyl)ammonium tetrafluoroborate CAS Name: [6-ethyl-2-(4-methoxyphenyl)-1-benzopyran-4-ylidene]-(3-hydroxypropyl)ammonium tetrafluoroborate IUPAC Name: [6-ethyl-2-(4-methoxyphenyl)chromen-4-ylidene]-(3-hydroxypropyl)azanium tetrafluoroborate Traditional Name: [6-ethyl-2-(4-methoxyphenyl)chromen-4-ylidene]-(3-hydroxypropyl)ammonium tetrafluoroborate Formula: C21H24BF4NO3 MolecularWeight: 425.224773

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CCC1=CC2=C(C=C1)OC(=CC2=[NH+]CCCO)C3=CC=C(C=C3)OC

Isomeric SMILES

[B-](F)(F)(F)F.CCC1=CC2=C(C=C1)OC(=CC2=[NH+]CCCO)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23NO3.BF4/c1-3-15-5-10-20-18(13-15)19(22-11-4-12-23)14-21(25-20)16-6-8-17(24-2)9-7-16;2-1(3,4)5/h5-10,13-14,23H,3-4,11-12H2,1-2H3;/q;-1/p+1