(E)-6-[1-(2-hydroxyethyloxy)icosan-2-yl-methanoyl-amino]pentadec-5-enoic acid

Systemtic Name: (E)-6-[1-(2-hydroxyethyloxy)icosan-2-yl-methanoyl-amino]pentadec-5-enoic acid Openeye Name: (E)-6-[formyl-[1-(2-hydroxyethoxymethyl)nonadecyl]amino]pentadec-5-enoic acid CAS Name: (E)-6-[formyl-[1-(2-hydroxyethoxy)eicosan-2-yl]amino]-5-pentadecenoic acid IUPAC Name: (E)-6-[formyl-[1-(2-hydroxyethoxy)icosan-2-yl]amino]pentadec-5-enoic acid Traditional Name: (E)-6-[formyl-[1-(2-hydroxyethoxymethyl)nonadecyl]amino]pentadec-5-enoic acid Formula: C38H73NO5 MolecularWeight: 623.98992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(COCCO)N(C=O)C(=CCCCC(=O)O)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(COCCO)N(C=O)/C(=C/CCCC(=O)O)/CCCCCCCCC

InChI

InChI=1S/C38H73NO5/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-21-23-25-30-37(34-44-33-32-40)39(35-41)36(29-26-27-31-38(42)43)28-24-22-20-10-8-6-4-2/h29,35,37,40H,3-28,30-34H2,1-2H3,(H,42,43)/b36-29+