8-(5-bicyclo[3.3.1]nonanyl)-3,6-dimethyl-3-phenyl-2,4-dihydro-1,3-benzothiazin-3-ium

Systemtic Name: 8-(5-bicyclo[3.3.1]nonanyl)-3,6-dimethyl-3-phenyl-2,4-dihydro-1,3-benzothiazin-3-ium Openeye Name: 8-(5-bicyclo[3.3.1]nonanyl)-3,6-dimethyl-3-phenyl-2,4-dihydro-1,3-benzothiazin-3-ium CAS Name: 8-(5-bicyclo[3.3.1]nonanyl)-3,6-dimethyl-3-phenyl-2,4-dihydro-1,3-benzothiazin-3-ium IUPAC Name: 8-(5-bicyclo[3.3.1]nonanyl)-3,6-dimethyl-3-phenyl-2,4-dihydro-1,3-benzothiazin-3-ium Traditional Name: 8-(5-bicyclo[3.3.1]nonanyl)-3,6-dimethyl-3-phenyl-2,4-dihydro-1,3-benzothiazin-3-ium Formula: C25H32NS+ MolecularWeight: 378.59328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C[N+](CS2)(C)C3=CC=CC=C3)C45CCCC(C4)CCC5

Isomeric SMILES

CC1=CC(=C2C(=C1)C[N+](CS2)(C)C3=CC=CC=C3)C45CCCC(C4)CCC5

InChI

InChI=1S/C25H32NS/c1-19-14-21-17-26(2,22-10-4-3-5-11-22)18-27-24(21)23(15-19)25-12-6-8-20(16-25)9-7-13-25/h3-5,10-11,14-15,20H,6-9,12-13,16-18H2,1-2H3/q+1