[3-[2,3-bis(oxidanyl)propoxy]-2-oxidanyl-propyl] 3-phenyl-2-(undec-10-enoylamino)propanoate

Systemtic Name: [3-[2,3-bis(oxidanyl)propoxy]-2-oxidanyl-propyl] 3-phenyl-2-(undec-10-enoylamino)propanoate Openeye Name: [3-(2,3-dihydroxypropoxy)-2-hydroxy-propyl] 3-phenyl-2-(undec-10-enoylamino)propanoate CAS Name: 2-(1-oxoundec-10-enylamino)-3-phenylpropanoic acid [3-(2,3-dihydroxypropoxy)-2-hydroxypropyl] ester IUPAC Name: [3-(2,3-dihydroxypropoxy)-2-hydroxypropyl] 3-phenyl-2-(undec-10-enoylamino)propanoate Traditional Name: 3-phenyl-2-(undec-10-enoylamino)propionic acid (3-glyceryloxy-2-hydroxy-propyl) ester Formula: C26H41NO7 MolecularWeight: 479.60624

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)OCC(COCC(CO)O)O

Isomeric SMILES

C=CCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)OCC(COCC(CO)O)O

InChI

InChI=1S/C26H41NO7/c1-2-3-4-5-6-7-8-12-15-25(31)27-24(16-21-13-10-9-11-14-21)26(32)34-20-23(30)19-33-18-22(29)17-28/h2,9-11,13-14,22-24,28-30H,1,3-8,12,15-20H2,(H,27,31)