2-acetyloxybenzoic acid; 2,4-bis(azanyl)butanoic acid

Systemtic Name: 2-acetyloxybenzoic acid; 2,4-bis(azanyl)butanoic acid Openeye Name: 2-acetoxybenzoic acid; 2,4-diaminobutanoic acid CAS Name: 2-acetyloxybenzoic acid; 2,4-diaminobutanoic acid IUPAC Name: 2-acetyloxybenzoic acid; 2,4-diaminobutanoic acid Traditional Name: 2-acetoxybenzoic acid; 2,4-diaminobutyric acid Formula: C13H18N2O6 MolecularWeight: 298.29182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)O.C(CN)C(C(=O)O)N

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)O.C(CN)C(C(=O)O)N

InChI

InChI=1S/C9H8O4.C4H10N2O2/c1-6(10)13-8-5-3-2-4-7(8)9(11)12;5-2-1-3(6)4(7)8/h2-5H,1H3,(H,11,12);3H,1-2,5-6H2,(H,7,8)