octadecanoate; 1-phenylethylazanium

Systemtic Name: octadecanoate; 1-phenylethylazanium Openeye Name: octadecanoate; 1-phenylethylammonium CAS Name: octadecanoate; 1-phenylethylammonium IUPAC Name: octadecanoate; 1-phenylethylazanium Traditional Name: 1-phenylethylammonium; stearate Formula: C26H47NO2 MolecularWeight: 405.65688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)[O-].CC(C1=CC=CC=C1)[NH3+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)[O-].CC(C1=CC=CC=C1)[NH3+]

InChI

InChI=1S/C18H36O2.C8H11N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-7(9)8-5-3-2-4-6-8/h2-17H2,1H3,(H,19,20);2-7H,9H2,1H3