sodium 4-[ethyl-(2-propan-2-ylphenyl)amino]butanoate

Systemtic Name: sodium 4-[ethyl-(2-propan-2-ylphenyl)amino]butanoate Openeye Name: sodium 4-(N-ethyl-2-isopropyl-anilino)butanoate CAS Name: sodium 4-(N-ethyl-2-propan-2-ylanilino)butanoate IUPAC Name: sodium 4-(N-ethyl-2-propan-2-ylanilino)butanoate Traditional Name: sodium 4-(N-ethyl-2-isopropyl-anilino)butyrate Formula: C15H22NNaO2 MolecularWeight: 271.33045

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23NO2.Na/c1-4-16(11-7-10-15(17)18)14-9-6-5-8-13(14)12(2)3;/h5-6,8-9,12H,4,7,10-11H2,1-3H3,(H,17,18);/q;+1/p-1