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sodium 4-[(2S)-2-ethoxy-3-oxidanylidene-3-propan-2-yloxy-propyl]phenolate

sodium 4-[(2S)-2-ethoxy-3-oxidanylidene-3-propan-2-yloxy-propyl]phenolate

Systemtic Name:sodium 4-[(2S)-2-ethoxy-3-oxidanylidene-3-propan-2-yloxy-propyl]phenolate
Openeye Name:sodium 4-[(2S)-2-ethoxy-3-isopropoxy-3-oxo-propyl]phenolate
CAS Name:sodium 4-[(2S)-2-ethoxy-3-oxo-3-propan-2-yloxypropyl]phenolate
IUPAC Name:sodium 4-[(2S)-2-ethoxy-3-oxo-3-propan-2-yloxypropyl]phenolate
Traditional Name:sodium 4-[(2S)-2-ethoxy-3-isopropoxy-3-keto-propyl]phenolate
Formula: C14H19NaO4
MolecularWeight: 274.28803
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)[O-])C(=O)OC(C)C.[Na+]


Isomeric SMILES

CCO[C@@H](CC1=CC=C(C=C1)[O-])C(=O)OC(C)C.[Na+]


InChI

InChI=1S/C14H20O4.Na/c1-4-17-13(14(16)18-10(2)3)9-11-5-7-12(15)8-6-11;/h5-8,10,13,15H,4,9H2,1-3H3;/q;+1/p-1/t13-;/m0./s1


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