2-[5-[hexadecyl-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-2-oxaldehydoyl-phenyl]ethanoate

Systemtic Name: 2-[5-[hexadecyl-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-2-oxaldehydoyl-phenyl]ethanoate Openeye Name: 2-[5-[hexadecyl-(2-oxido-2-oxo-ethyl)amino]-2-oxaldehydoyl-phenyl]acetate CAS Name: 2-[5-[hexadecyl-(2-oxido-2-oxoethyl)amino]-2-oxaldehydoylphenyl]acetate IUPAC Name: 2-[5-[hexadecyl-(2-oxido-2-oxoethyl)amino]-2-oxaldehydoylphenyl]acetate Traditional Name: 2-[5-[cetyl-(2-keto-2-oxido-ethyl)amino]-2-glyoxyloyl-phenyl]acetate Formula: C28H41NO6-2 MolecularWeight: 487.62824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN(CC(=O)[O-])C1=CC(=C(C=C1)C(=O)C=O)CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCN(CC(=O)[O-])C1=CC(=C(C=C1)C(=O)C=O)CC(=O)[O-]

InChI

InChI=1S/C28H43NO6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-29(21-28(34)35)24-16-17-25(26(31)22-30)23(19-24)20-27(32)33/h16-17,19,22H,2-15,18,20-21H2,1H3,(H,32,33)(H,34,35)/p-2