3-[[2,6-bis(chloranyl)phenyl]methylazaniumyl]propanoate

Systemtic Name: 3-[[2,6-bis(chloranyl)phenyl]methylazaniumyl]propanoate Openeye Name: 3-[(2,6-dichlorophenyl)methylammonio]propanoate CAS Name: 3-[(2,6-dichlorophenyl)methylammonio]propanoate IUPAC Name: 3-[(2,6-dichlorophenyl)methylazaniumyl]propanoate Traditional Name: 3-[(2,6-dichlorobenzyl)ammonio]propionate Formula: C10H11Cl2NO2 MolecularWeight: 248.10584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C[NH2+]CCC(=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)C[NH2+]CCC(=O)[O-])Cl

InChI

InChI=1S/C10H11Cl2NO2/c11-8-2-1-3-9(12)7(8)6-13-5-4-10(14)15/h1-3,13H,4-6H2,(H,14,15)