(phenylmethyl) 2-[(4-butoxyphenyl)-ethanoyl-amino]-3-oxidanyl-butanoate

Systemtic Name: (phenylmethyl) 2-[(4-butoxyphenyl)-ethanoyl-amino]-3-oxidanyl-butanoate Openeye Name: benzyl 2-(N-acetyl-4-butoxy-anilino)-3-hydroxy-butanoate CAS Name: 2-(N-acetyl-4-butoxyanilino)-3-hydroxybutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(N-acetyl-4-butoxyanilino)-3-hydroxybutanoate Traditional Name: 2-(N-acetyl-4-butoxy-anilino)-3-hydroxy-butyric acid benzyl ester Formula: C23H29NO5 MolecularWeight: 399.48006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N(C(C(C)O)C(=O)OCC2=CC=CC=C2)C(=O)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N(C(C(C)O)C(=O)OCC2=CC=CC=C2)C(=O)C

InChI

InChI=1S/C23H29NO5/c1-4-5-15-28-21-13-11-20(12-14-21)24(18(3)26)22(17(2)25)23(27)29-16-19-9-7-6-8-10-19/h6-14,17,22,25H,4-5,15-16H2,1-3H3