trimethyl-[4-oxidanyl-4-oxidanylidene-2-[oxidanyl-[5-(3-pentoxyphenyl)pentoxy]phosphoryl]oxy-butyl]azanium

Systemtic Name: trimethyl-[4-oxidanyl-4-oxidanylidene-2-[oxidanyl-[5-(3-pentoxyphenyl)pentoxy]phosphoryl]oxy-butyl]azanium Openeye Name: [4-hydroxy-2-[hydroxy-[5-(3-pentoxyphenyl)pentoxy]phosphoryl]oxy-4-oxo-butyl]-trimethyl-ammonium CAS Name: [4-hydroxy-2-[hydroxy-[5-(3-pentoxyphenyl)pentoxy]phosphoryl]oxy-4-oxobutyl]-trimethylammonium IUPAC Name: [4-hydroxy-2-[hydroxy-[5-(3-pentoxyphenyl)pentoxy]phosphoryl]oxy-4-oxobutyl]-trimethylazanium Traditional Name: [2-[5-(3-amoxyphenyl)pentoxy-hydroxy-phosphoryl]oxy-4-hydroxy-4-keto-butyl]-trimethyl-ammonium Formula: C23H41NO7P+ MolecularWeight: 474.547901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)CCCCCOP(=O)(O)OC(CC(=O)O)C[N+](C)(C)C

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)CCCCCOP(=O)(O)OC(CC(=O)O)C[N+](C)(C)C

InChI

InChI=1S/C23H40NO7P/c1-5-6-9-15-29-21-14-11-13-20(17-21)12-8-7-10-16-30-32(27,28)31-22(18-23(25)26)19-24(2,3)4/h11,13-14,17,22H,5-10,12,15-16,18-19H2,1-4H3,(H-,25,26,27,28)/p+1