N-[(2S)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[(2S)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[(1S)-1-benzyl-2-(4-methyl-1-piperidyl)-2-oxo-ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[(2S)-1-(4-methyl-1-piperidinyl)-1-oxo-3-phenylpropan-2-yl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[(2S)-1-(4-methylpiperidin-1-yl)-1-oxo-3-phenylpropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-(4-methylpiperidino)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1CCN(CC1)C(=O)[C@H](CC2=CC=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H28N2O5S/c1-17-9-11-25(12-10-17)23(26)20(15-18-5-3-2-4-6-18)24-31(27,28)19-7-8-21-22(16-19)30-14-13-29-21/h2-8,16-17,20,24H,9-15H2,1H3/t20-/m0/s1