16-[2,5-bis(oxidanylidene)-3-(phenylmethyl)pyrrolidin-1-yl]oxy-16-oxidanylidene-hexadecanoic acid

Systemtic Name: 16-[2,5-bis(oxidanylidene)-3-(phenylmethyl)pyrrolidin-1-yl]oxy-16-oxidanylidene-hexadecanoic acid Openeye Name: 16-(3-benzyl-2,5-dioxo-pyrrolidin-1-yl)oxy-16-oxo-hexadecanoic acid CAS Name: 16-[[2,5-dioxo-3-(phenylmethyl)-1-pyrrolidinyl]oxy]-16-oxohexadecanoic acid IUPAC Name: 16-(3-benzyl-2,5-dioxopyrrolidin-1-yl)oxy-16-oxohexadecanoic acid Traditional Name: 16-(3-benzyl-2,5-diketo-pyrrolidino)oxy-16-keto-palmitic acid Formula: C27H39NO6 MolecularWeight: 473.60166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)OC(=O)CCCCCCCCCCCCCCC(=O)O)CC2=CC=CC=C2

Isomeric SMILES

C1C(C(=O)N(C1=O)OC(=O)CCCCCCCCCCCCCCC(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C27H39NO6/c29-24-21-23(20-22-16-12-11-13-17-22)27(33)28(24)34-26(32)19-15-10-8-6-4-2-1-3-5-7-9-14-18-25(30)31/h11-13,16-17,23H,1-10,14-15,18-21H2,(H,30,31)