6-methyl-3-phenethyl-3,4-dihydro-2H-1,3-benzothiazin-3-ium

Systemtic Name: 6-methyl-3-phenethyl-3,4-dihydro-2H-1,3-benzothiazin-3-ium Openeye Name: 6-methyl-3-phenethyl-3,4-dihydro-2H-1,3-benzothiazin-3-ium CAS Name: 6-methyl-3-phenethyl-3,4-dihydro-2H-1,3-benzothiazin-3-ium IUPAC Name: 6-methyl-3-phenethyl-3,4-dihydro-2H-1,3-benzothiazin-3-ium Traditional Name: 6-methyl-3-phenethyl-3,4-dihydro-2H-1,3-benzothiazin-3-ium Formula: C17H20NS+ MolecularWeight: 270.4124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC[NH+](C2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)SC[NH+](C2)CCC3=CC=CC=C3

InChI

InChI=1S/C17H19NS/c1-14-7-8-17-16(11-14)12-18(13-19-17)10-9-15-5-3-2-4-6-15/h2-8,11H,9-10,12-13H2,1H3/p+1