3-hexadecoxypropyl 4-[[2,2-bis(dimethoxyphosphoryl)-2-oxidanyl-ethyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 3-hexadecoxypropyl 4-[[2,2-bis(dimethoxyphosphoryl)-2-oxidanyl-ethyl]amino]-4-oxidanylidene-butanoate Openeye Name: 3-hexadecoxypropyl 4-[[2,2-bis(dimethoxyphosphoryl)-2-hydroxy-ethyl]amino]-4-oxo-butanoate CAS Name: 4-[[2,2-bis(dimethoxyphosphoryl)-2-hydroxyethyl]amino]-4-oxobutanoic acid 3-hexadecoxypropyl ester IUPAC Name: 3-hexadecoxypropyl 4-[[2,2-bis(dimethoxyphosphoryl)-2-hydroxyethyl]amino]-4-oxobutanoate Traditional Name: 4-[[2,2-bis(dimethoxyphosphoryl)-2-hydroxy-ethyl]amino]-4-keto-butyric acid 3-cetyloxypropyl ester Formula: C29H59NO11P2 MolecularWeight: 659.726382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCCOC(=O)CCC(=O)NCC(O)(P(=O)(OC)OC)P(=O)(OC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCCOC(=O)CCC(=O)NCC(O)(P(=O)(OC)OC)P(=O)(OC)OC

InChI

InChI=1S/C29H59NO11P2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-40-24-20-25-41-28(32)22-21-27(31)30-26-29(33,42(34,36-2)37-3)43(35,38-4)39-5/h33H,6-26H2,1-5H3,(H,30,31)