5-[[3-carboxy-4-(tetradecanoylamino)phenyl]methyl]-2-(tetradecanoylamino)benzoic acid

Systemtic Name: 5-[[3-carboxy-4-(tetradecanoylamino)phenyl]methyl]-2-(tetradecanoylamino)benzoic acid Openeye Name: 5-[[3-carboxy-4-(tetradecanoylamino)phenyl]methyl]-2-(tetradecanoylamino)benzoic acid CAS Name: 5-[[3-carboxy-4-(1-oxotetradecylamino)phenyl]methyl]-2-(1-oxotetradecylamino)benzoic acid IUPAC Name: 5-[[3-carboxy-4-(tetradecanoylamino)phenyl]methyl]-2-(tetradecanoylamino)benzoic acid Traditional Name: 5-[3-carboxy-4-(tetradecanoylamino)benzyl]-2-(tetradecanoylamino)benzoic acid Formula: C43H66N2O6 MolecularWeight: 706.99394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NC1=C(C=C(C=C1)CC2=CC(=C(C=C2)NC(=O)CCCCCCCCCCCCC)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)NC1=C(C=C(C=C1)CC2=CC(=C(C=C2)NC(=O)CCCCCCCCCCCCC)C(=O)O)C(=O)O

InChI

InChI=1S/C43H66N2O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-40(46)44-38-29-27-34(32-36(38)42(48)49)31-35-28-30-39(37(33-35)43(50)51)45-41(47)26-24-22-20-18-16-14-12-10-8-6-4-2/h27-30,32-33H,3-26,31H2,1-2H3,(H,44,46)(H,45,47)(H,48,49)(H,50,51)