5-(tert-butylamino)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(tert-butylamino)benzene-1,3-dicarboxylic acid Openeye Name: 5-(tert-butylamino)benzene-1,3-dicarboxylic acid CAS Name: 5-(tert-butylamino)benzene-1,3-dicarboxylic acid IUPAC Name: 5-(tert-butylamino)benzene-1,3-dicarboxylic acid Traditional Name: 5-(tert-butylamino)isophthalic acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=CC(=CC(=C1)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)NC1=CC(=CC(=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C12H15NO4/c1-12(2,3)13-9-5-7(10(14)15)4-8(6-9)11(16)17/h4-6,13H,1-3H3,(H,14,15)(H,16,17)