2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-phenethyl-propanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-phenethyl-propanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-phenethyl-propanamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-phenethylpropanamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-phenethylpropanamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-phenethyl-propionamide Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1)SC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C(=O)NCCC1=CC=CC=C1)SC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H21NO3S/c1-14(19(21)20-10-9-15-5-3-2-4-6-15)24-16-7-8-17-18(13-16)23-12-11-22-17/h2-8,13-14H,9-12H2,1H3,(H,20,21)