1,3-benzothiazol-2-yl-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]azanium tetrafluoroborate

Systemtic Name: 1,3-benzothiazol-2-yl-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]azanium tetrafluoroborate Openeye Name: 1,3-benzothiazol-2-yl-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]ammonium tetrafluoroborate CAS Name: 1,3-benzothiazol-2-yl-[2-(3,4-dimethoxyphenyl)-1-benzopyran-4-ylidene]ammonium tetrafluoroborate IUPAC Name: 1,3-benzothiazol-2-yl-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]azanium tetrafluoroborate Traditional Name: 1,3-benzothiazol-2-yl-[2-(3,4-dimethoxyphenyl)chromen-4-ylidene]ammonium tetrafluoroborate Formula: C24H19BF4N2O3S MolecularWeight: 502.288873

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.COC1=C(C=C(C=C1)C2=CC(=[NH+]C3=NC4=CC=CC=C4S3)C5=CC=CC=C5O2)OC

Isomeric SMILES

[B-](F)(F)(F)F.COC1=C(C=C(C=C1)C2=CC(=[NH+]C3=NC4=CC=CC=C4S3)C5=CC=CC=C5O2)OC

InChI

InChI=1S/C24H18N2O3S.BF4/c1-27-20-12-11-15(13-22(20)28-2)21-14-18(16-7-3-5-9-19(16)29-21)26-24-25-17-8-4-6-10-23(17)30-24;2-1(3,4)5/h3-14H,1-2H3;/q;-1/p+1