(4-ethoxycarbonylphenyl)methylazanium; 4-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: (4-ethoxycarbonylphenyl)methylazanium; 4-oxidanyl-4-oxidanylidene-butanoate Openeye Name: (4-ethoxycarbonylphenyl)methylammonium; 4-hydroxy-4-oxo-butanoate CAS Name: (4-ethoxycarbonylphenyl)methylammonium; 4-hydroxy-4-oxobutanoate IUPAC Name: (4-ethoxycarbonylphenyl)methylazanium; 4-hydroxy-4-oxobutanoate Traditional Name: (4-carbethoxybenzyl)ammonium; 4-hydroxy-4-keto-butyrate Formula: C14H19NO6 MolecularWeight: 297.30376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C[NH3+].C(CC(=O)[O-])C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C[NH3+].C(CC(=O)[O-])C(=O)O

InChI

InChI=1S/C10H13NO2.C4H6O4/c1-2-13-10(12)9-5-3-8(7-11)4-6-9;5-3(6)1-2-4(7)8/h3-6H,2,7,11H2,1H3;1-2H2,(H,5,6)(H,7,8)