hexyl 2-(hexadecanoylamino)-3-(1H-indol-3-yl)propanoate

Systemtic Name: hexyl 2-(hexadecanoylamino)-3-(1H-indol-3-yl)propanoate Openeye Name: hexyl 2-(hexadecanoylamino)-3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)-2-(1-oxohexadecylamino)propanoic acid hexyl ester IUPAC Name: hexyl 2-(hexadecanoylamino)-3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)-2-palmitamido-propionic acid hexyl ester Formula: C33H54N2O3 MolecularWeight: 526.79346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OCCCCCC

InChI

InChI=1S/C33H54N2O3/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-24-32(36)35-31(33(37)38-25-21-8-6-4-2)26-28-27-34-30-23-20-19-22-29(28)30/h19-20,22-23,27,31,34H,3-18,21,24-26H2,1-2H3,(H,35,36)