fluoranyl-bis(oxidanidyl)borane; 3-prop-2-enyl-1,3-benzothiazol-3-ium

Systemtic Name: fluoranyl-bis(oxidanidyl)borane; 3-prop-2-enyl-1,3-benzothiazol-3-ium Openeye Name: 3-allyl-1,3-benzothiazol-3-ium; fluoro(dioxido)borane CAS Name: fluoro(dioxido)borane; 3-prop-2-enyl-1,3-benzothiazol-3-ium IUPAC Name: fluoro(dioxido)borane; 3-prop-2-enyl-1,3-benzothiazol-3-ium Traditional Name: 3-allyl-1,3-benzothiazol-3-ium; fluoro(dioxido)borane Formula: C80H80B4F4N8O8S8 MolecularWeight: 1657.297613

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Descriptors Computed from Structure

Canonical SMILES:

B([O-])([O-])F.B([O-])([O-])F.B([O-])([O-])F.B([O-])([O-])F.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21

Isomeric SMILES

B([O-])([O-])F.B([O-])([O-])F.B([O-])([O-])F.B([O-])([O-])F.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21.C=CC[N+]1=CSC2=CC=CC=C21

InChI

InChI=1S/8C10H10NS.4BFO2/c8*1-2-7-11-8-12-10-6-4-3-5-9(10)11;4*2-1(3)4/h8*2-6,8H,1,7H2;;;;/q8*+1;4*-2