ethyl 4-[[3,5-bis(decylcarbamoyl)phenyl]-(4-ethoxy-4-oxidanylidene-butyl)amino]butanoate

Systemtic Name: ethyl 4-[[3,5-bis(decylcarbamoyl)phenyl]-(4-ethoxy-4-oxidanylidene-butyl)amino]butanoate Openeye Name: ethyl 4-[3,5-bis(decylcarbamoyl)-N-(4-ethoxy-4-oxo-butyl)anilino]butanoate CAS Name: 4-[3,5-bis[(decylamino)-oxomethyl]-N-(4-ethoxy-4-oxobutyl)anilino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3,5-bis(decylcarbamoyl)-N-(4-ethoxy-4-oxobutyl)anilino]butanoate Traditional Name: 4-[3,5-bis(decylcarbamoyl)-N-(4-ethoxy-4-keto-butyl)anilino]butyric acid ethyl ester Formula: C40H69N3O6 MolecularWeight: 687.99236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC(=O)C1=CC(=CC(=C1)N(CCCC(=O)OCC)CCCC(=O)OCC)C(=O)NCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCNC(=O)C1=CC(=CC(=C1)N(CCCC(=O)OCC)CCCC(=O)OCC)C(=O)NCCCCCCCCCC

InChI

InChI=1S/C40H69N3O6/c1-5-9-11-13-15-17-19-21-27-41-39(46)34-31-35(40(47)42-28-22-20-18-16-14-12-10-6-2)33-36(32-34)43(29-23-25-37(44)48-7-3)30-24-26-38(45)49-8-4/h31-33H,5-30H2,1-4H3,(H,41,46)(H,42,47)