[2-benzamido-1-oxidanyl-3-(phenylcarbonyloxy)octadecan-4-yl] benzoate

Systemtic Name: [2-benzamido-1-oxidanyl-3-(phenylcarbonyloxy)octadecan-4-yl] benzoate Openeye Name: 1-(2-benzamido-1-benzoyloxy-3-hydroxy-propyl)pentadecyl benzoate CAS Name: benzoic acid (2-benzamido-3-benzoyloxy-1-hydroxyoctadecan-4-yl) ester IUPAC Name: (2-benzamido-3-benzoyloxy-1-hydroxyoctadecan-4-yl) benzoate Traditional Name: benzoic acid 1-(2-benzamido-1-benzoyloxy-3-hydroxy-propyl)pentadecyl ester Formula: C39H51NO6 MolecularWeight: 629.82534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(C(CO)NC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCC(C(C(CO)NC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C39H51NO6/c1-2-3-4-5-6-7-8-9-10-11-12-22-29-35(45-38(43)32-25-18-14-19-26-32)36(46-39(44)33-27-20-15-21-28-33)34(30-41)40-37(42)31-23-16-13-17-24-31/h13-21,23-28,34-36,41H,2-12,22,29-30H2,1H3,(H,40,42)