methyl (2S)-3-[2-dimethylaminoethyloxy(oxidanyl)phosphoryl]oxy-2-(octadecanoylamino)propanoate

Systemtic Name: methyl (2S)-3-[2-dimethylaminoethyloxy(oxidanyl)phosphoryl]oxy-2-(octadecanoylamino)propanoate Openeye Name: methyl (2S)-3-[2-dimethylaminoethyloxy(hydroxy)phosphoryl]oxy-2-(octadecanoylamino)propanoate CAS Name: (2S)-3-[2-dimethylaminoethyloxy(hydroxy)phosphoryl]oxy-2-(1-oxooctadecylamino)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-[2-dimethylaminoethyloxy(hydroxy)phosphoryl]oxy-2-(octadecanoylamino)propanoate Traditional Name: (2S)-3-[2-dimethylaminoethyloxy(hydroxy)phosphoryl]oxy-2-stearamido-propionic acid methyl ester Formula: C26H53N2O7P MolecularWeight: 536.681981

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(COP(=O)(O)OCCN(C)C)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP(=O)(O)OCCN(C)C)C(=O)OC

InChI

InChI=1S/C26H53N2O7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)27-24(26(30)33-4)23-35-36(31,32)34-22-21-28(2)3/h24H,5-23H2,1-4H3,(H,27,29)(H,31,32)/t24-/m0/s1