1-azanylethyl 2-hexadecyl-3-oxidanylidene-icosanoate

Systemtic Name: 1-azanylethyl 2-hexadecyl-3-oxidanylidene-icosanoate Openeye Name: 1-aminoethyl 2-hexadecyl-3-oxo-icosanoate CAS Name: 2-hexadecyl-3-oxoeicosanoic acid 1-aminoethyl ester IUPAC Name: 1-aminoethyl 2-hexadecyl-3-oxoicosanoate Traditional Name: 2-cetyl-3-keto-arachidic acid 1-aminoethyl ester Formula: C38H75NO3 MolecularWeight: 594.007

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCC)C(=O)OC(C)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C(CCCCCCCCCCCCCCCC)C(=O)OC(C)N

InChI

InChI=1S/C38H75NO3/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-37(40)36(38(41)42-35(3)39)33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h35-36H,4-34,39H2,1-3H3