3-azanyl-4-ethanoyl-5-ethoxy-phthalic acid

Systemtic Name: 3-azanyl-4-ethanoyl-5-ethoxy-phthalic acid Openeye Name: 4-acetyl-3-amino-5-ethoxy-phthalic acid CAS Name: 4-acetyl-3-amino-5-ethoxyphthalic acid IUPAC Name: 4-acetyl-3-amino-5-ethoxyphthalic acid Traditional Name: 4-acetyl-3-amino-5-ethoxy-phthalic acid Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C(=C1)C(=O)O)C(=O)O)N)C(=O)C

Isomeric SMILES

CCOC1=C(C(=C(C(=C1)C(=O)O)C(=O)O)N)C(=O)C

InChI

InChI=1S/C12H13NO6/c1-3-19-7-4-6(11(15)16)9(12(17)18)10(13)8(7)5(2)14/h4H,3,13H2,1-2H3,(H,15,16)(H,17,18)