[2-butanoyl-4-(octadecanoylamino)phenyl] 2-dimethylaminoethyl hydrogen phosphate

Systemtic Name: [2-butanoyl-4-(octadecanoylamino)phenyl] 2-dimethylaminoethyl hydrogen phosphate Openeye Name: [2-butanoyl-4-(octadecanoylamino)phenyl] 2-dimethylaminoethyl hydrogen phosphate CAS Name: 2-dimethylaminoethyl [2-(1-oxobutyl)-4-(1-oxooctadecylamino)phenyl] hydrogen phosphate IUPAC Name: [2-butanoyl-4-(octadecanoylamino)phenyl] 2-dimethylaminoethyl hydrogen phosphate Traditional Name: (2-butyryl-4-stearamido-phenyl) 2-dimethylaminoethyl hydrogen phosphate Formula: C32H57N2O6P MolecularWeight: 596.778541

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)OP(=O)(O)OCCN(C)C)C(=O)CCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC1=CC(=C(C=C1)OP(=O)(O)OCCN(C)C)C(=O)CCC

InChI

InChI=1S/C32H57N2O6P/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-32(36)33-28-23-24-31(29(27-28)30(35)21-6-2)40-41(37,38)39-26-25-34(3)4/h23-24,27H,5-22,25-26H2,1-4H3,(H,33,36)(H,37,38)