N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-methylsulfonyl-benzamide Openeye Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-methylsulfonyl-benzamide CAS Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-methylsulfonylbenzamide IUPAC Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-methylsulfonylbenzamide Traditional Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-mesyl-benzamide Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCCO2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H19NO5S/c1-12(14-5-8-16-17(11-14)24-10-9-23-16)19-18(20)13-3-6-15(7-4-13)25(2,21)22/h3-8,11-12H,9-10H2,1-2H3,(H,19,20)/t12-/m0/s1