2-[[4-[2,6-di(propan-2-yl)phenoxy]-4-oxidanylidene-butoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[[4-[2,6-di(propan-2-yl)phenoxy]-4-oxidanylidene-butoxy]-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[[4-(2,6-diisopropylphenoxy)-4-oxo-butoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[[4-[2,6-di(propan-2-yl)phenoxy]-4-oxobutoxy]-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[[4-[2,6-di(propan-2-yl)phenoxy]-4-oxobutoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[[4-(2,6-diisopropylphenoxy)-4-keto-butoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C21H37NO6P+ MolecularWeight: 430.495341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)CCCOP(=O)(O)OCC[N+](C)(C)C

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)CCCOP(=O)(O)OCC[N+](C)(C)C

InChI

InChI=1S/C21H36NO6P/c1-16(2)18-10-8-11-19(17(3)4)21(18)28-20(23)12-9-14-26-29(24,25)27-15-13-22(5,6)7/h8,10-11,16-17H,9,12-15H2,1-7H3/p+1