N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-(4-methylphenyl)sulfonyl-propanamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-(4-methylphenyl)sulfonyl-propanamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-(p-tolylsulfonyl)propanamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-(4-methylphenyl)sulfonylpropanamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-(4-methylphenyl)sulfonylpropanamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3-tosyl-propionamide Formula: C19H21NO5S MolecularWeight: 375.43874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)NC[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C19H21NO5S/c1-14-6-8-16(9-7-14)26(22,23)11-10-19(21)20-12-15-13-24-17-4-2-3-5-18(17)25-15/h2-9,15H,10-13H2,1H3,(H,20,21)/t15-/m0/s1