2-methyl-4H-3,1-benzoxathiine-2-carbonitrile

Systemtic Name: 2-methyl-4H-3,1-benzoxathiine-2-carbonitrile Openeye Name: 2-methyl-4H-3,1-benzoxathiine-2-carbonitrile CAS Name: 2-methyl-4H-3,1-benzoxathiin-2-carbonitrile IUPAC Name: 2-methyl-4H-3,1-benzoxathiine-2-carbonitrile Traditional Name: 2-methyl-4H-3,1-benzoxathiin-2-carbonitrile Formula: C10H9NOS MolecularWeight: 191.24956

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC2=CC=CC=C2S1)C#N

Isomeric SMILES

CC1(OCC2=CC=CC=C2S1)C#N

InChI

InChI=1S/C10H9NOS/c1-10(7-11)12-6-8-4-2-3-5-9(8)13-10/h2-5H,6H2,1H3