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3-cyclohexylidene-8-methyl-6-phenylsulfanyl-2,4-dihydro-1,3-benzoxazin-3-ium

3-cyclohexylidene-8-methyl-6-phenylsulfanyl-2,4-dihydro-1,3-benzoxazin-3-ium

Systemtic Name:3-cyclohexylidene-8-methyl-6-phenylsulfanyl-2,4-dihydro-1,3-benzoxazin-3-ium
Openeye Name:3-cyclohexylidene-8-methyl-6-phenylsulfanyl-2,4-dihydro-1,3-benzoxazin-3-ium
CAS Name:3-cyclohexylidene-8-methyl-6-(phenylthio)-2,4-dihydro-1,3-benzoxazin-3-ium
IUPAC Name:3-cyclohexylidene-8-methyl-6-phenylsulfanyl-2,4-dihydro-1,3-benzoxazin-3-ium
Traditional Name:3-cyclohexylidene-8-methyl-6-(phenylthio)-2,4-dihydro-1,3-benzoxazin-3-ium
Formula: C21H24NOS+
MolecularWeight: 338.48636
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)SC3=CC=CC=C3)C[N+](=C4CCCCC4)CO2


Isomeric SMILES

CC1=C2C(=CC(=C1)SC3=CC=CC=C3)C[N+](=C4CCCCC4)CO2


InChI

InChI=1S/C21H24NOS/c1-16-12-20(24-19-10-6-3-7-11-19)13-17-14-22(15-23-21(16)17)18-8-4-2-5-9-18/h3,6-7,10-13H,2,4-5,8-9,14-15H2,1H3/q+1


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