(phenylmethyl) 2-[(3-acetyloxy-5-octadecoxy-phenyl)-(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[(3-acetyloxy-5-octadecoxy-phenyl)-(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]ethanoate Openeye Name: benzyl 2-(3-acetoxy-N-(2-benzyloxy-2-oxo-ethyl)-5-octadecoxy-anilino)acetate CAS Name: 2-(3-acetyloxy-5-octadecoxy-N-(2-oxo-2-phenylmethoxyethyl)anilino)acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(3-acetyloxy-5-octadecoxy-N-(2-oxo-2-phenylmethoxyethyl)anilino)acetate Traditional Name: 2-(3-acetoxy-N-(2-benzoxy-2-keto-ethyl)-5-stearyloxy-anilino)acetic acid benzyl ester Formula: C44H61NO7 MolecularWeight: 715.95764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)OC(=O)C)N(CC(=O)OCC2=CC=CC=C2)CC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1)OC(=O)C)N(CC(=O)OCC2=CC=CC=C2)CC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C44H61NO7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-29-49-41-30-40(31-42(32-41)52-37(2)46)45(33-43(47)50-35-38-25-20-18-21-26-38)34-44(48)51-36-39-27-22-19-23-28-39/h18-23,25-28,30-32H,3-17,24,29,33-36H2,1-2H3