ethanedioate; 2-[3-(methylaminomethyl)phenyl]ethanoate

Systemtic Name: ethanedioate; 2-[3-(methylaminomethyl)phenyl]ethanoate Openeye Name: 2-[3-(methylaminomethyl)phenyl]acetate; oxalate CAS Name: 2-[3-(methylaminomethyl)phenyl]acetate; oxalate IUPAC Name: 2-[3-(methylaminomethyl)phenyl]acetate; oxalate Traditional Name: 2-[3-(methylaminomethyl)phenyl]acetate; oxalate Formula: C12H12NO6-3 MolecularWeight: 266.22678

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC=CC(=C1)CC(=O)[O-].C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CNCC1=CC=CC(=C1)CC(=O)[O-].C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/C10H13NO2.C2H2O4/c1-11-7-9-4-2-3-8(5-9)6-10(12)13;3-1(4)2(5)6/h2-5,11H,6-7H2,1H3,(H,12,13);(H,3,4)(H,5,6)/p-3