sodium 7-[(2,6-dimethylphenyl)-ethyl-amino]heptanoate

Systemtic Name: sodium 7-[(2,6-dimethylphenyl)-ethyl-amino]heptanoate Openeye Name: sodium 7-(N-ethyl-2,6-dimethyl-anilino)heptanoate CAS Name: sodium 7-(N-ethyl-2,6-dimethylanilino)heptanoate IUPAC Name: sodium 7-(N-ethyl-2,6-dimethylanilino)heptanoate Traditional Name: sodium 7-(N-ethyl-2,6-dimethyl-anilino)enanthate Formula: C17H26NNaO2 MolecularWeight: 299.38361

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCCCC(=O)[O-])C1=C(C=CC=C1C)C.[Na+]

Isomeric SMILES

CCN(CCCCCCC(=O)[O-])C1=C(C=CC=C1C)C.[Na+]

InChI

InChI=1S/C17H27NO2.Na/c1-4-18(13-8-6-5-7-12-16(19)20)17-14(2)10-9-11-15(17)3;/h9-11H,4-8,12-13H2,1-3H3,(H,19,20);/q;+1/p-1