(6-chloranyl-2-phenyl-chromen-4-ylidene)-(4-nitro-2-oxidanyl-phenyl)azanium tetrafluoroborate

Systemtic Name: (6-chloranyl-2-phenyl-chromen-4-ylidene)-(4-nitro-2-oxidanyl-phenyl)azanium tetrafluoroborate Openeye Name: (6-chloro-2-phenyl-chromen-4-ylidene)-(2-hydroxy-4-nitro-phenyl)ammonium tetrafluoroborate CAS Name: (6-chloro-2-phenyl-1-benzopyran-4-ylidene)-(2-hydroxy-4-nitrophenyl)ammonium tetrafluoroborate IUPAC Name: (6-chloro-2-phenylchromen-4-ylidene)-(2-hydroxy-4-nitrophenyl)azanium tetrafluoroborate Traditional Name: (6-chloro-2-phenyl-chromen-4-ylidene)-(2-hydroxy-4-nitro-phenyl)ammonium tetrafluoroborate Formula: C21H14BClF4N2O4 MolecularWeight: 480.604473

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[NH+]C3=C(C=C(C=C3)[N+](=O)[O-])O)C4=C(O2)C=CC(=C4)Cl

Isomeric SMILES

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[NH+]C3=C(C=C(C=C3)[N+](=O)[O-])O)C4=C(O2)C=CC(=C4)Cl

InChI

InChI=1S/C21H13ClN2O4.BF4/c22-14-6-9-20-16(10-14)18(12-21(28-20)13-4-2-1-3-5-13)23-17-8-7-15(24(26)27)11-19(17)25;2-1(3,4)5/h1-12,25H;/q;-1/p+1