(2,3-dimethyl-4-octadecyl-phenyl)carbonylazanium

Systemtic Name: (2,3-dimethyl-4-octadecyl-phenyl)carbonylazanium Openeye Name: (2,3-dimethyl-4-octadecyl-benzoyl)ammonium CAS Name: [(2,3-dimethyl-4-octadecylphenyl)-oxomethyl]ammonium IUPAC Name: (2,3-dimethyl-4-octadecylbenzoyl)azanium Traditional Name: (2,3-dimethyl-4-stearyl-benzoyl)ammonium Formula: C27H48NO+ MolecularWeight: 402.67612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=C(C(=C(C=C1)C(=O)[NH3+])C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=C(C(=C(C=C1)C(=O)[NH3+])C)C

InChI

InChI=1S/C27H47NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-21-22-26(27(28)29)24(3)23(25)2/h21-22H,4-20H2,1-3H3,(H2,28,29)/p+1