4-(2,3-dihydro-1,4-benzoxathiin-5-yl)-N-methyl-butanamide

Systemtic Name: 4-(2,3-dihydro-1,4-benzoxathiin-5-yl)-N-methyl-butanamide Openeye Name: 4-(2,3-dihydro-1,4-benzoxathiin-5-yl)-N-methyl-butanamide CAS Name: 4-(2,3-dihydro-1,4-benzoxathiin-5-yl)-N-methylbutanamide IUPAC Name: 4-(2,3-dihydro-1,4-benzoxathiin-5-yl)-N-methylbutanamide Traditional Name: 4-(2,3-dihydro-1,4-benzoxathiin-5-yl)-N-methyl-butyramide Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCCC1=C2C(=CC=C1)OCCS2

Isomeric SMILES

CNC(=O)CCCC1=C2C(=CC=C1)OCCS2

InChI

InChI=1S/C13H17NO2S/c1-14-12(15)7-3-5-10-4-2-6-11-13(10)17-9-8-16-11/h2,4,6H,3,5,7-9H2,1H3,(H,14,15)