(phenylmethyl) (2R)-2-[(2S)-2-(4,4-diethoxybutylamino)heptyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R)-2-[(2S)-2-(4,4-diethoxybutylamino)heptyl]piperidine-1-carboxylate Openeye Name: benzyl (2R)-2-[(2S)-2-(4,4-diethoxybutylamino)heptyl]piperidine-1-carboxylate CAS Name: (2R)-2-[(2S)-2-(4,4-diethoxybutylamino)heptyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R)-2-[(2S)-2-(4,4-diethoxybutylamino)heptyl]piperidine-1-carboxylate Traditional Name: (2R)-2-[(2S)-2-(4,4-diethoxybutylamino)heptyl]piperidine-1-carboxylic acid benzyl ester Formula: C28H48N2O4 MolecularWeight: 476.69172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC1CCCCN1C(=O)OCC2=CC=CC=C2)NCCCC(OCC)OCC

Isomeric SMILES

CCCCC[C@@H](C[C@H]1CCCCN1C(=O)OCC2=CC=CC=C2)NCCCC(OCC)OCC

InChI

InChI=1S/C28H48N2O4/c1-4-7-9-17-25(29-20-14-19-27(32-5-2)33-6-3)22-26-18-12-13-21-30(26)28(31)34-23-24-15-10-8-11-16-24/h8,10-11,15-16,25-27,29H,4-7,9,12-14,17-23H2,1-3H3/t25-,26+/m0/s1