5-methoxy-N-(4-methylsulfanylphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 5-methoxy-N-(4-methylsulfanylphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 5-methoxy-N-(4-methylsulfanylphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 5-methoxy-N-[4-(methylthio)phenyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 5-methoxy-N-(4-methylsulfanylphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 5-methoxy-N-[4-(methylthio)phenyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)C(=O)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C17H17NO4S/c1-20-14-9-11(10-15-16(14)22-8-7-21-15)17(19)18-12-3-5-13(23-2)6-4-12/h3-6,9-10H,7-8H2,1-2H3,(H,18,19)