8-(1-methylcyclohexyl)-3-phenyl-2H-1,3-benzothiazin-3-ium

Systemtic Name: 8-(1-methylcyclohexyl)-3-phenyl-2H-1,3-benzothiazin-3-ium Openeye Name: 8-(1-methylcyclohexyl)-3-phenyl-2H-1,3-benzothiazin-3-ium CAS Name: 8-(1-methylcyclohexyl)-3-phenyl-2H-1,3-benzothiazin-3-ium IUPAC Name: 8-(1-methylcyclohexyl)-3-phenyl-2H-1,3-benzothiazin-3-ium Traditional Name: 8-(1-methylcyclohexyl)-3-phenyl-2H-1,3-benzothiazin-3-ium Formula: C21H24NS+ MolecularWeight: 322.48696

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1)C2=CC=CC3=C2SC[N+](=C3)C4=CC=CC=C4

Isomeric SMILES

CC1(CCCCC1)C2=CC=CC3=C2SC[N+](=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H24NS/c1-21(13-6-3-7-14-21)19-12-8-9-17-15-22(16-23-20(17)19)18-10-4-2-5-11-18/h2,4-5,8-12,15H,3,6-7,13-14,16H2,1H3/q+1