N-[2-[[(2S)-2-azanyl-2-phenyl-ethanoyl]amino]ethyl]-3,4,5-tridodecoxy-benzamide

Systemtic Name: N-[2-[[(2S)-2-azanyl-2-phenyl-ethanoyl]amino]ethyl]-3,4,5-tridodecoxy-benzamide Openeye Name: N-[2-[[(2S)-2-amino-2-phenyl-acetyl]amino]ethyl]-3,4,5-tridodecoxy-benzamide CAS Name: N-[2-[[(2S)-2-amino-1-oxo-2-phenylethyl]amino]ethyl]-3,4,5-tridodecoxybenzamide IUPAC Name: N-[2-[[(2S)-2-amino-2-phenylacetyl]amino]ethyl]-3,4,5-tridodecoxybenzamide Traditional Name: N-[2-[[(2S)-2-amino-2-phenyl-acetyl]amino]ethyl]-3,4,5-trilauryloxy-benzamide Formula: C53H91N3O5 MolecularWeight: 850.30674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C(=O)NCCNC(=O)C(C2=CC=CC=C2)N

Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C(=O)NCCNC(=O)[C@H](C2=CC=CC=C2)N

InChI

InChI=1S/C53H91N3O5/c1-4-7-10-13-16-19-22-25-28-34-41-59-48-44-47(52(57)55-39-40-56-53(58)50(54)46-37-32-31-33-38-46)45-49(60-42-35-29-26-23-20-17-14-11-8-5-2)51(48)61-43-36-30-27-24-21-18-15-12-9-6-3/h31-33,37-38,44-45,50H,4-30,34-36,39-43,54H2,1-3H3,(H,55,57)(H,56,58)/t50-/m0/s1