3-[(Z)-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethanoyl]hydrazinylidene]methyl]-4-ethoxy-benzoate

Systemtic Name: 3-[(Z)-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethanoyl]hydrazinylidene]methyl]-4-ethoxy-benzoate Openeye Name: 3-[(Z)-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-acetyl]hydrazono]methyl]-4-ethoxy-benzoate CAS Name: 3-[(Z)-[[2-(1,3-benzodioxol-5-ylmethylamino)-1,2-dioxoethyl]hydrazinylidene]methyl]-4-ethoxybenzoate IUPAC Name: 3-[(Z)-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoacetyl]hydrazinylidene]methyl]-4-ethoxybenzoate Traditional Name: 4-ethoxy-3-[(Z)-[[2-keto-2-(piperonylamino)acetyl]hydrazono]methyl]benzoate Formula: C20H18N3O7- MolecularWeight: 412.37282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)[O-])C=NNC(=O)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)[O-])/C=N\NC(=O)C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H19N3O7/c1-2-28-15-6-4-13(20(26)27)8-14(15)10-22-23-19(25)18(24)21-9-12-3-5-16-17(7-12)30-11-29-16/h3-8,10H,2,9,11H2,1H3,(H,21,24)(H,23,25)(H,26,27)/p-1/b22-10-