[(2R,3S)-3-[bis(phenylmethyl)amino]-2-oxidanyl-butyl] hexanoate

Systemtic Name: [(2R,3S)-3-[bis(phenylmethyl)amino]-2-oxidanyl-butyl] hexanoate Openeye Name: [(2R,3S)-3-(dibenzylamino)-2-hydroxy-butyl] hexanoate CAS Name: hexanoic acid [(2R,3S)-3-[bis(phenylmethyl)amino]-2-hydroxybutyl] ester IUPAC Name: [(2R,3S)-3-(dibenzylamino)-2-hydroxybutyl] hexanoate Traditional Name: hexanoic acid [(2R,3S)-3-(dibenzylamino)-2-hydroxy-butyl] ester Formula: C24H33NO3 MolecularWeight: 383.52372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCC(C(C)N(CC1=CC=CC=C1)CC2=CC=CC=C2)O

Isomeric SMILES

CCCCCC(=O)OC[C@@H]([C@H](C)N(CC1=CC=CC=C1)CC2=CC=CC=C2)O

InChI

InChI=1S/C24H33NO3/c1-3-4-7-16-24(27)28-19-23(26)20(2)25(17-21-12-8-5-9-13-21)18-22-14-10-6-11-15-22/h5-6,8-15,20,23,26H,3-4,7,16-19H2,1-2H3/t20-,23-/m0/s1