sodium 2-[bis(2-hydroxyethyl)amino]-4-phenyl-butanoate

Systemtic Name: sodium 2-[bis(2-hydroxyethyl)amino]-4-phenyl-butanoate Openeye Name: sodium 2-[bis(2-hydroxyethyl)amino]-4-phenyl-butanoate CAS Name: sodium 2-[bis(2-hydroxyethyl)amino]-4-phenylbutanoate IUPAC Name: sodium 2-[bis(2-hydroxyethyl)amino]-4-phenylbutanoate Traditional Name: sodium 2-[bis(2-hydroxyethyl)amino]-4-phenyl-butyrate Formula: C14H20NNaO4 MolecularWeight: 289.30267

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C(=O)[O-])N(CCO)CCO.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CCC(C(=O)[O-])N(CCO)CCO.[Na+]

InChI

InChI=1S/C14H21NO4.Na/c16-10-8-15(9-11-17)13(14(18)19)7-6-12-4-2-1-3-5-12;/h1-5,13,16-17H,6-11H2,(H,18,19);/q;+1/p-1