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

Systemtic Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-methylsulfonyl-benzamide Openeye Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-methylsulfonyl-benzamide CAS Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-3-methylsulfonylbenzamide IUPAC Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-3-methylsulfonylbenzamide Traditional Name: N-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-3-mesyl-benzamide Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO5S/c1-13(2)19(14-7-8-17-18(12-14)26-10-9-25-17)21-20(22)15-5-4-6-16(11-15)27(3,23)24/h4-8,11-13,19H,9-10H2,1-3H3,(H,21,22)/t19-/m0/s1