3,5-bis(azanyl)-4-(2-methylpentan-2-yl)benzoate

Systemtic Name: 3,5-bis(azanyl)-4-(2-methylpentan-2-yl)benzoate Openeye Name: 3,5-diamino-4-(1,1-dimethylbutyl)benzoate CAS Name: 3,5-diamino-4-(2-methylpentan-2-yl)benzoate IUPAC Name: 3,5-diamino-4-(2-methylpentan-2-yl)benzoate Traditional Name: 3,5-diamino-4-(1,1-dimethylbutyl)benzoate Formula: C13H19N2O2- MolecularWeight: 235.30216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C1=C(C=C(C=C1N)C(=O)[O-])N

Isomeric SMILES

CCCC(C)(C)C1=C(C=C(C=C1N)C(=O)[O-])N

InChI

InChI=1S/C13H20N2O2/c1-4-5-13(2,3)11-9(14)6-8(12(16)17)7-10(11)15/h6-7H,4-5,14-15H2,1-3H3,(H,16,17)/p-1