3,5-bis(aminomethyl)benzoate

Systemtic Name: 3,5-bis(aminomethyl)benzoate Openeye Name: 3,5-bis(aminomethyl)benzoate CAS Name: 3,5-bis(aminomethyl)benzoate IUPAC Name: 3,5-bis(aminomethyl)benzoate Traditional Name: 3,5-bis(aminomethyl)benzoate Formula: C9H11N2O2- MolecularWeight: 179.19584

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1CN)C(=O)[O-])CN

Isomeric SMILES

C1=C(C=C(C=C1CN)C(=O)[O-])CN

InChI

InChI=1S/C9H12N2O2/c10-4-6-1-7(5-11)3-8(2-6)9(12)13/h1-3H,4-5,10-11H2,(H,12,13)/p-1