(2-azanyl-2-oxidanylidene-ethyl) (E)-2-[1-[(E)-octadec-9-enoyl]oxyethyl]octadec-9-enoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) (E)-2-[1-[(E)-octadec-9-enoyl]oxyethyl]octadec-9-enoate Openeye Name: (2-amino-2-oxo-ethyl) (E)-2-[1-[(E)-octadec-9-enoyl]oxyethyl]octadec-9-enoate CAS Name: (E)-2-[1-[(E)-1-oxooctadec-9-enoxy]ethyl]-9-octadecenoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) (E)-2-[1-[(E)-octadec-9-enoyl]oxyethyl]octadec-9-enoate Traditional Name: (E)-2-[1-[(E)-octadec-9-enoyl]oxyethyl]octadec-9-enoic acid (2-amino-2-keto-ethyl) ester Formula: C40H73NO5 MolecularWeight: 648.01132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OC(C)C(CCCCCCC=CCCCCCCCC)C(=O)OCC(=O)N

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OC(C)C(CCCCCC/C=C/CCCCCCCC)C(=O)OCC(=O)N

InChI

InChI=1S/C40H73NO5/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-39(43)46-36(3)37(40(44)45-35-38(41)42)33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h18-21,36-37H,4-17,22-35H2,1-3H3,(H2,41,42)/b20-18+,21-19+