2-[3-[2-(2-hydroxyethyloxy)ethanoyloxy]octadecanoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[3-[2-(2-hydroxyethyloxy)ethanoyloxy]octadecanoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[3-[2-(2-hydroxyethoxy)acetyl]oxyoctadecanoylamino]-3-phenyl-propanoic acid CAS Name: 2-[[3-[2-(2-hydroxyethoxy)-1-oxoethoxy]-1-oxooctadecyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[3-[2-(2-hydroxyethoxy)acetyl]oxyoctadecanoylamino]-3-phenylpropanoic acid Traditional Name: 2-[3-[2-(2-hydroxyethoxy)acetyl]oxyoctadecanoylamino]-3-phenyl-propionic acid Formula: C31H51NO7 MolecularWeight: 549.73914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CC(=O)NC(CC1=CC=CC=C1)C(=O)O)OC(=O)COCCO

Isomeric SMILES

CCCCCCCCCCCCCCCC(CC(=O)NC(CC1=CC=CC=C1)C(=O)O)OC(=O)COCCO

InChI

InChI=1S/C31H51NO7/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-27(39-30(35)25-38-22-21-33)24-29(34)32-28(31(36)37)23-26-18-15-14-16-19-26/h14-16,18-19,27-28,33H,2-13,17,20-25H2,1H3,(H,32,34)(H,36,37)