4-azanyl-3,5-diethyl-phthalate

Systemtic Name: 4-azanyl-3,5-diethyl-phthalate Openeye Name: 4-amino-3,5-diethyl-phthalate CAS Name: 4-amino-3,5-diethylphthalate IUPAC Name: 4-amino-3,5-diethylphthalate Traditional Name: 4-amino-3,5-diethyl-phthalate Formula: C12H13NO4-2 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=C1)C(=O)[O-])C(=O)[O-])CC)N

Isomeric SMILES

CCC1=C(C(=C(C(=C1)C(=O)[O-])C(=O)[O-])CC)N

InChI

InChI=1S/C12H15NO4/c1-3-6-5-8(11(14)15)9(12(16)17)7(4-2)10(6)13/h5H,3-4,13H2,1-2H3,(H,14,15)(H,16,17)/p-2