dicyclohexylazanium; 2-diethoxyphosphoryl-3-(4-methylphenoxy)propanoate

Systemtic Name: dicyclohexylazanium; 2-diethoxyphosphoryl-3-(4-methylphenoxy)propanoate Openeye Name: dicyclohexylammonium; 2-diethoxyphosphoryl-3-(4-methylphenoxy)propanoate CAS Name: dicyclohexylammonium; 2-diethoxyphosphoryl-3-(4-methylphenoxy)propanoate IUPAC Name: dicyclohexylazanium; 2-diethoxyphosphoryl-3-(4-methylphenoxy)propanoate Traditional Name: dicyclohexylammonium; 2-diethoxyphosphoryl-3-(4-methylphenoxy)propionate Formula: C26H44NO6P MolecularWeight: 497.604421

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(COC1=CC=C(C=C1)C)C(=O)[O-])OCC.C1CCC(CC1)[NH2+]C2CCCCC2

Isomeric SMILES

CCOP(=O)(C(COC1=CC=C(C=C1)C)C(=O)[O-])OCC.C1CCC(CC1)[NH2+]C2CCCCC2

InChI

InChI=1S/C14H21O6P.C12H23N/c1-4-19-21(17,20-5-2)13(14(15)16)10-18-12-8-6-11(3)7-9-12;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h6-9,13H,4-5,10H2,1-3H3,(H,15,16);11-13H,1-10H2