[(2S,3R)-3-acetyloxy-2-[bis(phenylmethyl)amino]-6-oxidanylidene-octadecyl] ethanoate

Systemtic Name: [(2S,3R)-3-acetyloxy-2-[bis(phenylmethyl)amino]-6-oxidanylidene-octadecyl] ethanoate Openeye Name: [(2S,3R)-3-acetoxy-2-(dibenzylamino)-6-oxo-octadecyl] acetate CAS Name: acetic acid [(2S,3R)-3-acetyloxy-2-[bis(phenylmethyl)amino]-6-oxooctadecyl] ester IUPAC Name: [(2S,3R)-3-acetyloxy-2-(dibenzylamino)-6-oxooctadecyl] acetate Traditional Name: acetic acid [(2S,3R)-3-acetoxy-2-(dibenzylamino)-6-keto-octadecyl] ester Formula: C36H53NO5 MolecularWeight: 579.80972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)CCC(C(COC(=O)C)N(CC1=CC=CC=C1)CC2=CC=CC=C2)OC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C36H53NO5/c1-4-5-6-7-8-9-10-11-12-19-24-34(40)25-26-36(42-31(3)39)35(29-41-30(2)38)37(27-32-20-15-13-16-21-32)28-33-22-17-14-18-23-33/h13-18,20-23,35-36H,4-12,19,24-29H2,1-3H3/t35-,36+/m0/s1