sodium 2-[methyl-[(5-nonyl-2-oxidanyl-phenyl)methyl]amino]ethanoate

Systemtic Name: sodium 2-[methyl-[(5-nonyl-2-oxidanyl-phenyl)methyl]amino]ethanoate Openeye Name: sodium 2-[(2-hydroxy-5-nonyl-phenyl)methyl-methyl-amino]acetate CAS Name: sodium 2-[(2-hydroxy-5-nonylphenyl)methyl-methylamino]acetate IUPAC Name: sodium 2-[(2-hydroxy-5-nonylphenyl)methyl-methylamino]acetate Traditional Name: sodium 2-[(2-hydroxy-5-nonyl-benzyl)-methyl-amino]acetate Formula: C19H30NNaO3 MolecularWeight: 343.43617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC(=C(C=C1)O)CN(C)CC(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCC1=CC(=C(C=C1)O)CN(C)CC(=O)[O-].[Na+]

InChI

InChI=1S/C19H31NO3.Na/c1-3-4-5-6-7-8-9-10-16-11-12-18(21)17(13-16)14-20(2)15-19(22)23;/h11-13,21H,3-10,14-15H2,1-2H3,(H,22,23);/q;+1/p-1