[2-[[(2S)-1,5-didodecoxy-1,5-bis(oxidanylidene)pentan-2-yl]amino]-2-oxidanylidene-ethyl]-trimethyl-azanium chloride

Systemtic Name: [2-[[(2S)-1,5-didodecoxy-1,5-bis(oxidanylidene)pentan-2-yl]amino]-2-oxidanylidene-ethyl]-trimethyl-azanium chloride Openeye Name: [2-[[(1S)-4-dodecoxy-1-dodecoxycarbonyl-4-oxo-butyl]amino]-2-oxo-ethyl]-trimethyl-ammonium chloride CAS Name: [2-[[(2S)-1,5-didodecoxy-1,5-dioxopentan-2-yl]amino]-2-oxoethyl]-trimethylammonium chloride IUPAC Name: [2-[[(2S)-1,5-didodecoxy-1,5-dioxopentan-2-yl]amino]-2-oxoethyl]-trimethylazanium chloride Traditional Name: [2-keto-2-[[(1S)-4-keto-4-lauryloxy-1-lauryloxycarbonyl-butyl]amino]ethyl]-trimethyl-ammonium chloride Formula: C34H67ClN2O5 MolecularWeight: 619.35918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CCC(C(=O)OCCCCCCCCCCCC)NC(=O)C[N+](C)(C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CC[C@@H](C(=O)OCCCCCCCCCCCC)NC(=O)C[N+](C)(C)C.[Cl-]

InChI

InChI=1S/C34H66N2O5.ClH/c1-6-8-10-12-14-16-18-20-22-24-28-40-33(38)27-26-31(35-32(37)30-36(3,4)5)34(39)41-29-25-23-21-19-17-15-13-11-9-7-2;/h31H,6-30H2,1-5H3;1H/t31-;/m0./s1