5-chloranyl-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 5-chloranyl-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 5-chloro-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 5-chloro-N-methyl-N-[[4-(methylthio)phenyl]methyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 5-chloro-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 5-chloro-N-methyl-N-[4-(methylthio)benzyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C18H18ClNO3S MolecularWeight: 363.85842

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=O)C2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=O)C2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C18H18ClNO3S/c1-20(11-12-3-5-14(24-2)6-4-12)18(21)13-9-15(19)17-16(10-13)22-7-8-23-17/h3-6,9-10H,7-8,11H2,1-2H3