hexadecan-1-amine; 2-oxidanylbenzoate

Systemtic Name: hexadecan-1-amine; 2-oxidanylbenzoate Openeye Name: hexadecan-1-amine; 2-hydroxybenzoate CAS Name: 1-hexadecanamine; 2-hydroxybenzoate IUPAC Name: hexadecan-1-amine; 2-hydroxybenzoate Traditional Name: cetylamine; salicylate Formula: C23H40NO3- MolecularWeight: 378.5686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN.C1=CC=C(C(=C1)C(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCCN.C1=CC=C(C(=C1)C(=O)[O-])O

InChI

InChI=1S/C16H35N.C7H6O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17;8-6-4-2-1-3-5(6)7(9)10/h2-17H2,1H3;1-4,8H,(H,9,10)/p-1