[3-[(2S)-2-azanyl-3-(1H-indol-3-yl)propanoyl]oxy-2-oxidanyl-propyl] tetradecanoate

Systemtic Name: [3-[(2S)-2-azanyl-3-(1H-indol-3-yl)propanoyl]oxy-2-oxidanyl-propyl] tetradecanoate Openeye Name: [3-[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]oxy-2-hydroxy-propyl] tetradecanoate CAS Name: tetradecanoic acid [3-[(2S)-2-amino-3-(1H-indol-3-yl)-1-oxopropoxy]-2-hydroxypropyl] ester IUPAC Name: [3-[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]oxy-2-hydroxypropyl] tetradecanoate Traditional Name: myristic acid [3-[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]oxy-2-hydroxy-propyl] ester Formula: C28H44N2O5 MolecularWeight: 488.65936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OCC(COC(=O)C(CC1=CNC2=CC=CC=C21)N)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OCC(COC(=O)[C@H](CC1=CNC2=CC=CC=C21)N)O

InChI

InChI=1S/C28H44N2O5/c1-2-3-4-5-6-7-8-9-10-11-12-17-27(32)34-20-23(31)21-35-28(33)25(29)18-22-19-30-26-16-14-13-15-24(22)26/h13-16,19,23,25,30-31H,2-12,17-18,20-21,29H2,1H3/t23?,25-/m0/s1