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

Systemtic Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(phenylmethyl)propanamide Openeye Name: (2R)-N-benzyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanamide CAS Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(phenylmethyl)propanamide IUPAC Name: (2R)-N-benzyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)propanamide Traditional Name: (2R)-N-benzyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)propionamide Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1)SC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H19NO3S/c1-13(18(20)19-12-14-5-3-2-4-6-14)23-15-7-8-16-17(11-15)22-10-9-21-16/h2-8,11,13H,9-10,12H2,1H3,(H,19,20)/t13-/m1/s1