(phenylmethyl) 2-[(3-octadecoxyphenyl)amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[(3-octadecoxyphenyl)amino]ethanoate Openeye Name: benzyl 2-(3-octadecoxyanilino)acetate CAS Name: 2-(3-octadecoxyanilino)acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(3-octadecoxyanilino)acetate Traditional Name: 2-(3-stearyloxyanilino)acetic acid benzyl ester Formula: C33H51NO3 MolecularWeight: 509.76294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)NCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)NCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C33H51NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-26-36-32-25-21-24-31(27-32)34-28-33(35)37-29-30-22-18-17-19-23-30/h17-19,21-25,27,34H,2-16,20,26,28-29H2,1H3