2-(3,3-dimethyl-2H-1,4-benzoxathiin-7-yl)ethanal

Systemtic Name: 2-(3,3-dimethyl-2H-1,4-benzoxathiin-7-yl)ethanal Openeye Name: 2-(3,3-dimethyl-2H-1,4-benzoxathiin-7-yl)acetaldehyde CAS Name: 2-(3,3-dimethyl-2H-1,4-benzoxathiin-7-yl)acetaldehyde IUPAC Name: 2-(3,3-dimethyl-2H-1,4-benzoxathiin-7-yl)acetaldehyde Traditional Name: 2-(3,3-dimethyl-2H-1,4-benzoxathiin-7-yl)acetaldehyde Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(S1)C=CC(=C2)CC=O)C

Isomeric SMILES

CC1(COC2=C(S1)C=CC(=C2)CC=O)C

InChI

InChI=1S/C12H14O2S/c1-12(2)8-14-10-7-9(5-6-13)3-4-11(10)15-12/h3-4,6-7H,5,8H2,1-2H3