4-(1,3-benzodioxol-5-ylmethylamino)-4-oxidanylidene-but-2-enoate

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethylamino)-4-oxidanylidene-but-2-enoate Openeye Name: 4-(1,3-benzodioxol-5-ylmethylamino)-4-oxo-but-2-enoate CAS Name: 4-(1,3-benzodioxol-5-ylmethylamino)-4-oxo-2-butenoate IUPAC Name: 4-(1,3-benzodioxol-5-ylmethylamino)-4-oxobut-2-enoate Traditional Name: 4-keto-4-(piperonylamino)but-2-enoate Formula: C12H10NO5- MolecularWeight: 248.2115

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C=CC(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C=CC(=O)[O-]

InChI

InChI=1S/C12H11NO5/c14-11(3-4-12(15)16)13-6-8-1-2-9-10(5-8)18-7-17-9/h1-5H,6-7H2,(H,13,14)(H,15,16)/p-1