[2,14-dimethyl-8-(6-methylheptyl)pentadecan-8-yl]azanium; diphenyl phosphate

Systemtic Name: [2,14-dimethyl-8-(6-methylheptyl)pentadecan-8-yl]azanium; diphenyl phosphate Openeye Name: diphenyl phosphate; [7-methyl-1,1-bis(6-methylheptyl)octyl]ammonium CAS Name: [2,14-dimethyl-8-(6-methylheptyl)pentadecan-8-yl]ammonium; diphenyl phosphate IUPAC Name: [2,14-dimethyl-8-(6-methylheptyl)pentadecan-8-yl]azanium; diphenyl phosphate Traditional Name: diphenyl phosphate; [7-methyl-1,1-bis(6-methylheptyl)octyl]ammonium Formula: C37H64NO4P MolecularWeight: 617.882121

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC(CCCCCC(C)C)(CCCCCC(C)C)[NH3+].C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=CC=C2

Isomeric SMILES

CC(C)CCCCCC(CCCCCC(C)C)(CCCCCC(C)C)[NH3+].C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=CC=C2

InChI

InChI=1S/C25H53N.C12H11O4P/c1-22(2)16-10-7-13-19-25(26,20-14-8-11-17-23(3)4)21-15-9-12-18-24(5)6;13-17(14,15-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h22-24H,7-21,26H2,1-6H3;1-10H,(H,13,14)