4-(dimethylamino)butyl-[4-oxidanylidene-2-[(4-tetradecoxyphenyl)methyl]hexoxy]phosphinic acid

Systemtic Name: 4-(dimethylamino)butyl-[4-oxidanylidene-2-[(4-tetradecoxyphenyl)methyl]hexoxy]phosphinic acid Openeye Name: 4-(dimethylamino)butyl-[4-oxo-2-[(4-tetradecoxyphenyl)methyl]hexoxy]phosphinic acid CAS Name: 4-(dimethylamino)butyl-[4-oxo-2-[(4-tetradecoxyphenyl)methyl]hexoxy]phosphinic acid IUPAC Name: 4-(dimethylamino)butyl-[4-oxo-2-[(4-tetradecoxyphenyl)methyl]hexoxy]phosphinic acid Traditional Name: 4-(dimethylamino)butyl-[4-keto-2-(4-myristyloxybenzyl)hexoxy]phosphinic acid Formula: C33H60NO5P MolecularWeight: 581.806961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(CC(=O)CC)COP(=O)(CCCCN(C)C)O

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(CC(=O)CC)COP(=O)(CCCCN(C)C)O

InChI

InChI=1S/C33H60NO5P/c1-5-7-8-9-10-11-12-13-14-15-16-18-25-38-33-22-20-30(21-23-33)27-31(28-32(35)6-2)29-39-40(36,37)26-19-17-24-34(3)4/h20-23,31H,5-19,24-29H2,1-4H3,(H,36,37)