4-[(7-bromanyl-9H-fluoren-2-yl)sulfonyl]-1,1-dimethyl-1,4-diazepan-1-ium

Systemtic Name: 4-[(7-bromanyl-9H-fluoren-2-yl)sulfonyl]-1,1-dimethyl-1,4-diazepan-1-ium Openeye Name: 4-[(7-bromo-9H-fluoren-2-yl)sulfonyl]-1,1-dimethyl-1,4-diazepan-1-ium CAS Name: 4-[(7-bromo-9H-fluoren-2-yl)sulfonyl]-1,1-dimethyl-1,4-diazepan-1-ium IUPAC Name: 4-[(7-bromo-9H-fluoren-2-yl)sulfonyl]-1,1-dimethyl-1,4-diazepan-1-ium Traditional Name: 4-[(7-bromo-9H-fluoren-2-yl)sulfonyl]-1,1-dimethyl-1,4-diazepan-1-ium Formula: C20H24BrN2O2S+ MolecularWeight: 436.38576

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)C4=C(C3)C=C(C=C4)Br)C

Isomeric SMILES

C[N+]1(CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)C4=C(C3)C=C(C=C4)Br)C

InChI

InChI=1S/C20H24BrN2O2S/c1-23(2)10-3-8-22(9-11-23)26(24,25)18-5-7-20-16(14-18)12-15-13-17(21)4-6-19(15)20/h4-7,13-14H,3,8-12H2,1-2H3/q+1