(phenylmethyl) (2S,3R,6S)-6-(furan-3-yl)-3-methyl-2-(3-methyl-3-oxidanyl-butyl)piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S,3R,6S)-6-(furan-3-yl)-3-methyl-2-(3-methyl-3-oxidanyl-butyl)piperidine-1-carboxylate Openeye Name: benzyl (2S,3R,6S)-6-(3-furyl)-2-(3-hydroxy-3-methyl-butyl)-3-methyl-piperidine-1-carboxylate CAS Name: (2S,3R,6S)-6-(3-furanyl)-2-(3-hydroxy-3-methylbutyl)-3-methyl-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3R,6S)-6-(furan-3-yl)-2-(3-hydroxy-3-methylbutyl)-3-methylpiperidine-1-carboxylate Traditional Name: (2S,3R,6S)-6-(3-furyl)-2-(3-hydroxy-3-methyl-butyl)-3-methyl-piperidine-1-carboxylic acid benzyl ester Formula: C23H31NO4 MolecularWeight: 385.49654

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(N(C1CCC(C)(C)O)C(=O)OCC2=CC=CC=C2)C3=COC=C3

Isomeric SMILES

C[C@@H]1CC[C@H](N([C@H]1CCC(C)(C)O)C(=O)OCC2=CC=CC=C2)C3=COC=C3

InChI

InChI=1S/C23H31NO4/c1-17-9-10-21(19-12-14-27-16-19)24(20(17)11-13-23(2,3)26)22(25)28-15-18-7-5-4-6-8-18/h4-8,12,14,16-17,20-21,26H,9-11,13,15H2,1-3H3/t17-,20+,21+/m1/s1