(phenylmethyl) 2-[(3-octadecoxyphenyl)-(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[(3-octadecoxyphenyl)-(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]ethanoate Openeye Name: benzyl 2-(N-(2-benzyloxy-2-oxo-ethyl)-3-octadecoxy-anilino)acetate CAS Name: 2-(3-octadecoxy-N-(2-oxo-2-phenylmethoxyethyl)anilino)acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(3-octadecoxy-N-(2-oxo-2-phenylmethoxyethyl)anilino)acetate Traditional Name: 2-(N-(2-benzoxy-2-keto-ethyl)-3-stearyloxy-anilino)acetic acid benzyl ester Formula: C42H59NO5 MolecularWeight: 657.92156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C42H59NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-31-46-40-30-24-29-39(32-40)43(33-41(44)47-35-37-25-19-17-20-26-37)34-42(45)48-36-38-27-21-18-22-28-38/h17-22,24-30,32H,2-16,23,31,33-36H2,1H3