sodium 4-(hexadecylamino)benzoate

Systemtic Name: sodium 4-(hexadecylamino)benzoate Openeye Name: sodium 4-(hexadecylamino)benzoate CAS Name: sodium 4-(hexadecylamino)benzoate IUPAC Name: sodium 4-(hexadecylamino)benzoate Traditional Name: sodium 4-(cetylamino)benzoate Formula: C23H38NNaO2 MolecularWeight: 383.54309

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)[O-].[Na+]

InChI

InChI=1S/C23H39NO2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-24-22-18-16-21(17-19-22)23(25)26;/h16-19,24H,2-15,20H2,1H3,(H,25,26);/q;+1/p-1