(4-chloranyl-3-nitro-phenyl)-(2-phenylchromen-4-ylidene)azanium tetrafluoroborate

Systemtic Name: (4-chloranyl-3-nitro-phenyl)-(2-phenylchromen-4-ylidene)azanium tetrafluoroborate Openeye Name: (4-chloro-3-nitro-phenyl)-(2-phenylchromen-4-ylidene)ammonium tetrafluoroborate CAS Name: (4-chloro-3-nitrophenyl)-(2-phenyl-1-benzopyran-4-ylidene)ammonium tetrafluoroborate IUPAC Name: (4-chloro-3-nitrophenyl)-(2-phenylchromen-4-ylidene)azanium tetrafluoroborate Traditional Name: (4-chloro-3-nitro-phenyl)-(2-phenylchromen-4-ylidene)ammonium tetrafluoroborate Formula: C21H14BClF4N2O3 MolecularWeight: 464.605073

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[NH+]C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=CC=C4O2

Isomeric SMILES

[B-](F)(F)(F)F.C1=CC=C(C=C1)C2=CC(=[NH+]C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=CC=C4O2

InChI

InChI=1S/C21H13ClN2O3.BF4/c22-17-11-10-15(12-19(17)24(25)26)23-18-13-21(14-6-2-1-3-7-14)27-20-9-5-4-8-16(18)20;2-1(3,4)5/h1-13H;/q;-1/p+1