N-[(3S,5R,6S)-6-(hydroxymethyl)-4-oxidanylidene-5-phenylmethoxy-1-(phenylsulfonyl)piperidin-3-yl]-N-methyl-benzamide

Systemtic Name: N-[(3S,5R,6S)-6-(hydroxymethyl)-4-oxidanylidene-5-phenylmethoxy-1-(phenylsulfonyl)piperidin-3-yl]-N-methyl-benzamide Openeye Name: N-[(3S,5R,6S)-1-(benzenesulfonyl)-5-benzyloxy-6-(hydroxymethyl)-4-oxo-3-piperidyl]-N-methyl-benzamide CAS Name: N-[(3S,5R,6S)-1-(benzenesulfonyl)-6-(hydroxymethyl)-4-oxo-5-phenylmethoxy-3-piperidinyl]-N-methylbenzamide IUPAC Name: N-[(3S,5R,6S)-1-(benzenesulfonyl)-6-(hydroxymethyl)-4-oxo-5-phenylmethoxypiperidin-3-yl]-N-methylbenzamide Traditional Name: N-[(3S,5R,6S)-5-benzoxy-1-besyl-4-keto-6-methylol-3-piperidyl]-N-methyl-benzamide Formula: C27H28N2O6S MolecularWeight: 508.58602

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CN(C(C(C1=O)OCC2=CC=CC=C2)CO)S(=O)(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CN([C@H]1CN([C@H]([C@H](C1=O)OCC2=CC=CC=C2)CO)S(=O)(=O)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H28N2O6S/c1-28(27(32)21-13-7-3-8-14-21)23-17-29(36(33,34)22-15-9-4-10-16-22)24(18-30)26(25(23)31)35-19-20-11-5-2-6-12-20/h2-16,23-24,26,30H,17-19H2,1H3/t23-,24-,26+/m0/s1