sodium 5-[methyl(phenyl)amino]pentanoate

Systemtic Name: sodium 5-[methyl(phenyl)amino]pentanoate Openeye Name: sodium 5-(N-methylanilino)pentanoate CAS Name: sodium 5-(N-methylanilino)pentanoate IUPAC Name: sodium 5-(N-methylanilino)pentanoate Traditional Name: sodium 5-(N-methylanilino)valerate Formula: C12H16NNaO2 MolecularWeight: 229.25071

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCC(=O)[O-])C1=CC=CC=C1.[Na+]

Isomeric SMILES

CN(CCCCC(=O)[O-])C1=CC=CC=C1.[Na+]

InChI

InChI=1S/C12H17NO2.Na/c1-13(10-6-5-9-12(14)15)11-7-3-2-4-8-11;/h2-4,7-8H,5-6,9-10H2,1H3,(H,14,15);/q;+1/p-1